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evaluation license 3.40 0067 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 0.0500 0.7270 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 1.3690 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -0.3480 -1.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0020 1.1340 -1.0630 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2720 0.3280 -5.2160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1020 0.3990 -3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -0.3770 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -1.3460 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.5270 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -1.0620 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 1.6900 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 0.8280 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -1.0240 -5.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 1.1930 -5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 0.6600 -6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.7500 0.2530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7090 -0.9720 -1.1790 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5220 -2.4920 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.6300 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 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0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 M END > 4 $$$$ 5 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.7260 2.3330 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 0.9280 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.0440 0.9250 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2390 2.3160 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 1.3510 1.5270 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0840 -0.0530 1.1370 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4730 -1.0130 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -1.1590 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 1.3460 1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 0.1860 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 0.2360 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 1.4450 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 2.6120 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 2.5540 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 0.4050 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -1.4500 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.3350 2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.2290 3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -0.3540 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 1.7960 2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 1.4920 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 2.2500 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0310 0.8690 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 3.0120 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 2.6770 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 0.9480 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 0.5950 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 1.9850 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 3.3170 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -0.6110 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.9860 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -1.6810 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -1.7430 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -0.6690 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 3.5560 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 3.4560 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.7730 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.1400 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -1.4390 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 0.0940 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 2.1450 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.9560 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 2.6050 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 1.5820 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 2.6310 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 3.0820 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 0.3260 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 0.9030 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 18 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 M END > 5 $$$$ 6 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.2360 1.4860 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.0150 0.0800 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6900 -0.8150 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 1.8290 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 1.1010 1.5480 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1290 -0.3960 1.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7910 -1.0940 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -0.9890 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -0.7340 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.7040 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.2980 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 1.6920 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 1.3440 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 0.3700 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 0.6390 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 1.8630 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 2.8370 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 2.5740 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 2.1380 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 2.4610 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3570 3.3290 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.3240 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 2.0150 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.8070 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.3040 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 1.5240 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 2.9070 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -0.6550 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -2.1550 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -1.1930 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -1.7410 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -1.2060 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -1.1750 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 0.3470 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -2.4100 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -2.9140 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -2.6160 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 1.6700 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 1.1060 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 2.7230 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 -0.1210 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 3.7970 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.3410 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 1.2600 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 3.3390 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5760 2.6600 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2880 1.6120 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 3.1000 3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4280 3.5290 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 4.2080 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 0.1230 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 14 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 M END > 6 $$$$ 7 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.2870 1.5410 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.0400 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -0.7640 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 1.8850 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 1.1700 1.5270 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2080 -0.3280 1.4050 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9310 -1.0370 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -0.9350 2.2590 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9090 1.4510 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 0.4780 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 0.7960 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 2.0710 1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 3.0430 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 2.7310 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.6890 2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.2420 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 2.4030 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 2.8700 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 3.5170 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.7420 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -0.6400 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -1.3530 3.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 2.0610 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 1.8800 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -0.1900 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.2610 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 1.5610 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 2.9630 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -0.5820 3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -2.0920 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -1.5900 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 0.0380 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 4.0430 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 3.4960 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -1.2110 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.1560 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 0.3550 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.3310 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.8620 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.5720 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 1.5170 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 3.7560 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 3.1100 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3720 2.0760 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7480 4.4040 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 3.1850 3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 3.7580 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 1.6970 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 1.1580 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 2.7780 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -1.3180 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 22 51 1 0 0 0 0 M END > 7 $$$$ 8 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.2700 1.5260 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.0250 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.7740 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 1.8700 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.1500 1.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1710 -0.3470 1.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8720 -1.0480 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -0.9700 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 1.4080 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 0.4260 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 0.7140 1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 1.9670 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 2.9560 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 2.6710 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 4.1970 0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.7370 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.6710 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -2.2560 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 2.2630 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6390 2.0430 3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7960 1.3290 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 2.0500 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8570 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -0.2090 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.2720 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 1.5540 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 2.9480 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -0.6750 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -0.5800 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -2.1000 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -1.2610 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -1.6580 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -0.0540 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 3.4450 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 4.3060 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 1.7060 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 1.1530 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 2.7700 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -1.1800 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.1380 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 0.3780 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.3630 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -2.8720 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -2.5780 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 3.2980 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 1.0080 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 2.2570 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 2.7080 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4010 1.4850 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8650 1.5430 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6310 0.2940 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 M END > 8 $$$$ 9 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.4270 1.6130 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 0.1110 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.6570 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 1.9080 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 1.1740 1.5960 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2820 -0.3170 1.5510 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1420 -0.9930 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -0.8450 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 1.4860 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 0.5300 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 0.8570 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 2.1520 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 3.1130 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 2.7870 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -1.7930 0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -0.7420 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.3940 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.1610 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.7840 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 2.5170 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 3.5980 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 3.0450 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.1400 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 1.9620 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.1040 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.2080 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.5900 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 2.9830 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -2.0540 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.4910 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1210 0.1030 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 4.1300 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 3.5670 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.8610 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.8140 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.6800 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -2.4060 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -2.7420 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -2.3990 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.8090 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 1.1770 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 2.7980 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8260 1.6340 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 4.4810 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5430 3.8620 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 3.2220 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6850 3.3090 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 3.9270 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 2.2740 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 M END > 9 $$$$ 10 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1660 1.4290 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0700 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.8690 1.2000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6520 1.7620 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.0330 1.5750 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0280 -0.4680 1.4760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5790 -1.1640 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -0.8150 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 1.2670 1.5330 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5620 0.2710 2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 0.5520 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 1.7400 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 2.8680 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 2.6700 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -0.7480 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -2.3310 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.8320 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 1.6190 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 1.1560 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 1.9790 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 2.3360 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 3.1320 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -2.9500 0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -2.9300 0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 1.9740 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.7350 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.3110 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.3500 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 1.4530 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 2.8380 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.8660 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -2.2470 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -1.4830 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -0.2150 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 3.8040 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 2.9130 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 3.4180 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 2.7840 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -1.2350 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.2270 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 0.3060 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 1.5760 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 1.0430 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 2.6560 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4220 1.0760 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6910 2.5080 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4920 1.5150 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1680 3.2390 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 2.8780 4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 3.3040 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6940 4.0350 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -3.8580 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 23 2 0 0 0 0 16 24 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 52 1 0 0 0 0 M END > 10 $$$$ 11 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.1120 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4440 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0400 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.6460 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 0.1620 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 1.5170 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 2.1300 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 2.3440 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 1.7350 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 2.5090 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 3.8930 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0100 4.5080 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 3.7380 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.8640 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 5.8650 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3890 4.6510 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6380 3.9570 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 2.0510 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -0.6990 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -2.1250 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1910 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -0.2930 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 0.6580 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 2.0370 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 4.2130 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 6.2580 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7150 3.3300 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6960 3.3320 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4540 4.6790 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 2.2370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -2.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -2.4490 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.4590 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 6 2 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END > 11 $$$$ 12 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.0510 1.2490 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.2650 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.8930 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 1.7760 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.2470 1.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9400 -0.1870 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -0.8730 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -0.6260 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 1.4330 0.7870 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4980 0.8820 2.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5440 3.1830 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 2.9120 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 2.6810 1.7460 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9760 1.1410 1.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9050 0.7360 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 2.8450 1.8740 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1600 1.6180 2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 4.2130 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 4.1400 2.6210 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9660 4.2810 4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9350 4.4280 5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4070 4.3520 4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -0.9230 -1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 2.0950 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 3.3190 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 5.3400 1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1780 4.3490 3.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 1.3790 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 2.8480 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.6080 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 1.5800 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.9280 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.4680 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 2.8640 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -0.4630 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -1.9440 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.0390 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 -1.1060 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 0.8780 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 2.6480 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 4.2530 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 3.2300 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 3.4890 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 0.6950 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 0.9660 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 -0.3220 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5770 1.9420 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 1.0610 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 4.2100 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 4.1540 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 4.2830 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1010 4.4200 6.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5810 3.5720 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5050 5.3490 5.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 2.0190 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 1.7340 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 3.1360 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 3.1120 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 2.9020 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 4.3960 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 5.2460 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 6.2580 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1600 5.3710 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 23 2 0 0 0 0 3 6 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 29 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 18 49 1 0 0 0 0 19 26 1 0 0 0 0 19 50 1 0 0 0 0 20 22 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 27 2 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 M END > 12 $$$$ 13 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3740 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4560 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6780 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -0.9260 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -2.1390 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -2.0110 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -0.6330 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -0.4180 1.3830 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8380 0.7860 1.9410 N 0 0 3 0 0 0 0 0 0 0 0 0 4.7840 0.7210 3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -0.2470 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 -1.2290 0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4580 0.7730 1.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -1.2820 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8950 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 3.1770 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 2.0260 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -3.0770 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.7500 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -1.4730 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 0.2670 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 1.6200 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 1.6240 3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -0.1500 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 0.6390 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 -1.0730 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 6 2 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 30 1 0 0 0 0 M END > 13 $$$$ 14 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 1.7080 2.7600 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 1.5650 0.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9340 0.4180 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.3400 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 1.2720 1.8580 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3590 0.0870 1.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4520 -1.0030 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -1.5510 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 0.7990 1.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8900 -0.4490 2.8020 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9840 1.4300 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 1.9260 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 0.1680 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 -0.9550 2.5940 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6580 -2.0760 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 -2.4060 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 -0.1200 2.8200 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9750 -1.1720 3.9160 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4500 -1.5330 4.0820 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0850 -1.9520 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8830 -0.9170 1.6620 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3920 -0.6090 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 1.9670 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.7280 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 1.9190 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 -0.1070 4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 -0.5850 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1550 -0.4450 4.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6710 0.3580 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -0.8130 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -1.5450 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3850 -1.5200 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7710 -1.8470 0.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2980 0.8080 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -0.3370 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 0.5850 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 3.5380 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 3.1820 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 1.2130 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 1.9260 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 3.2050 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -0.6270 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -1.8250 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -2.3540 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 -1.9670 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 2.1610 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 2.7590 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.2970 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -1.8780 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -2.9850 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3430 -3.1840 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 -2.7870 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5060 -2.3870 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1600 -2.1070 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -2.9070 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -1.5300 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 0.1510 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 2.6720 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 0.7420 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.0380 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.7020 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 2.4790 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.1460 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.5960 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -0.9780 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 0.7210 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 0.1790 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 -1.3300 6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 0.2970 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -0.3050 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0980 -0.6130 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7340 0.1230 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 1.0720 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3400 0.7920 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -1.0470 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -1.6680 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -0.5920 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -0.7480 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -2.0140 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -2.2900 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 -2.4230 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2500 -0.7960 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1550 -2.2320 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 33 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 M END > 14 $$$$ 15 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 1.0390 2.6270 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.3330 -0.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5070 0.2330 0.7760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5180 2.3770 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 1.3620 1.6100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9460 0.0760 1.2180 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1200 -0.9600 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.3470 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 1.0560 1.7710 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4740 -0.1310 2.6680 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3560 1.9590 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 2.2910 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 0.7440 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -0.4830 2.5220 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3820 -1.5230 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9030 -1.6880 3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 0.6270 2.7880 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5730 -0.3580 3.9300 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0710 -0.5490 4.1530 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7910 -0.9440 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 0.0210 1.7230 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0060 0.1580 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.5750 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 0.4860 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 2.0000 2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 0.2460 4.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 0.2180 5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 0.6300 4.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1510 1.3850 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.0820 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -1.1120 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 -0.5710 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5320 -0.7390 0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 0.3750 1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 1.6150 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 0.8410 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -0.3270 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 3.3690 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 3.0300 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 0.9930 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 1.9770 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 3.3110 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -0.5760 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -1.8600 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.1080 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -1.7820 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0670 2.7740 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 3.0910 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 2.6580 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -1.3240 4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 -2.4970 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1510 -2.4120 4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -2.0690 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 -1.3660 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8710 -0.9730 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4770 -1.9510 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -0.8230 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8180 0.8700 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 2.2410 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.2500 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 1.4870 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 2.4370 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.2410 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 2.7800 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 -0.6030 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 1.0930 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 0.5180 4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -0.4820 6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 1.1680 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 0.3760 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5850 0.5710 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2300 1.2700 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 2.0460 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7430 1.8140 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.2790 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -1.9060 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.9860 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -0.3630 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -1.4760 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -1.9430 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 -1.5390 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9370 0.1040 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9820 -1.1090 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 0.5240 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 24 34 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 33 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 34 84 1 0 0 0 0 M END > 15 $$$$ 16 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 0.3940 1.9080 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.4080 0.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7820 -0.3520 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 2.1860 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 1.5260 1.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2370 0.0300 1.4320 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8990 -0.6540 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.5510 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 1.7280 1.3850 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8630 0.9060 2.3690 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8900 3.3710 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 3.2070 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 2.4080 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 0.9970 1.9790 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2320 0.3600 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7120 0.6820 2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2150 2.7980 1.6020 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9360 2.1900 2.8070 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4250 2.5240 2.7580 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0610 2.1090 1.4390 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3200 2.6820 0.2340 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8390 2.3040 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 0.1580 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.1760 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 2.2030 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 1.4970 3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 2.8070 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6200 3.9110 3.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4860 4.1940 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.8520 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 0.1860 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9120 2.0510 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3040 2.3650 -1.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4220 2.5610 1.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 3.8920 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.3540 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 1.4290 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 2.4030 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 2.3140 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 0.0430 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 1.7730 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 3.2600 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.2010 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -1.7140 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -1.0520 3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.0900 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 4.3480 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 3.7670 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 3.6330 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 0.6190 4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1210 -0.7390 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2900 0.2440 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 0.2430 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9190 1.9630 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 1.0140 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 1.2180 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 2.7430 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 0.5860 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.6750 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.6150 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 0.8860 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 2.2440 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 1.6340 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 3.2150 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 0.9700 4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 2.5550 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 1.3860 4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 2.3750 4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 3.8850 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 2.6000 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5460 4.1880 2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5440 4.4380 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9450 4.5660 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0880 4.6600 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.0150 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -2.4490 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -2.1480 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 0.6870 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5880 0.1080 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -0.8120 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7850 0.9690 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3970 2.4480 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7430 1.9980 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9710 2.2020 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 37 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 33 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 34 84 1 0 0 0 0 M END > 16 $$$$ 17 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 1.7080 2.7600 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 1.5650 0.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9340 0.4180 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.3400 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 1.2720 1.8580 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3590 0.0870 1.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4520 -1.0030 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -1.5510 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 0.7990 1.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8900 -0.4490 2.8020 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9840 1.4300 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 1.9260 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 0.1680 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 -0.9550 2.5940 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6580 -2.0760 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 -2.4060 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 -0.1200 2.8200 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9750 -1.1720 3.9160 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4500 -1.5330 4.0820 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0850 -1.9520 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8830 -0.9170 1.6620 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3920 -0.6090 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 1.9670 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.7280 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 1.9190 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 -0.1070 4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 -0.5850 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1550 -0.4450 4.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6710 0.3580 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -0.8130 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -1.5450 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3850 -1.5200 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0640 0.0500 2.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2980 0.8080 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -0.3370 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 0.5850 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 3.5380 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 3.1820 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 1.2130 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 1.9260 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 3.2050 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -0.6270 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -1.8250 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -2.3540 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 -1.9670 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 2.1610 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 2.7590 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.2970 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -1.8780 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -2.9850 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3430 -3.1840 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 -2.7870 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5060 -2.3870 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1600 -2.1070 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -2.9070 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -1.5300 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 0.1510 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 2.6720 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 0.7420 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.0380 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.7020 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 2.4790 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.1460 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.5960 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -0.9780 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 0.7210 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 0.1790 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 -1.3300 6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 0.2970 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -0.3050 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0980 -0.6130 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 1.0720 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3400 0.7920 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -1.0470 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -1.6680 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -0.5920 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -0.7480 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -2.0140 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -2.2900 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 -2.4230 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2500 -0.7960 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4420 -1.7690 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6270 0.8160 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 29 33 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 M END > 17 $$$$ 18 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 1.0390 2.6270 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.3330 -0.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5070 0.2330 0.7760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5180 2.3770 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 1.3620 1.6100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9460 0.0760 1.2180 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1200 -0.9600 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.3470 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 1.0560 1.7710 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4740 -0.1310 2.6680 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3560 1.9590 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 2.2910 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 0.7440 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -0.4830 2.5220 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3820 -1.5230 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9030 -1.6880 3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 0.6270 2.7880 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5730 -0.3580 3.9300 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0710 -0.5490 4.1530 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7910 -0.9440 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 0.0210 1.7230 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0060 0.1580 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.5750 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 0.4860 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 2.0000 2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 0.2460 4.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 0.2180 5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 0.6300 4.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1510 1.3850 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.0820 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -1.1120 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 -0.5710 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5660 1.2340 2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 0.3750 1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 1.6150 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 0.8410 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -0.3270 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 3.3690 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 3.0300 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 0.9930 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 1.9770 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 3.3110 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -0.5760 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -1.8600 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.1080 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -1.7820 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0670 2.7740 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 3.0910 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 2.6580 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -1.3240 4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 -2.4970 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1510 -2.4120 4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -2.0690 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 -1.3660 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8710 -0.9730 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4770 -1.9510 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -0.8230 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8180 0.8700 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 2.2410 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.2500 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 1.4870 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 2.4370 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.2410 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 2.7800 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 -0.6030 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 1.0930 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 0.5180 4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -0.4820 6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 1.1680 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 0.3760 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5850 0.5710 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 2.0460 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7430 1.8140 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.2790 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -1.9060 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.9860 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -0.3630 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -1.4760 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -1.9430 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 -1.5390 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9370 0.1040 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1980 -0.6990 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0360 2.0630 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 0.5240 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 24 34 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 29 33 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 34 84 1 0 0 0 0 M END > 18 $$$$ 19 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 1.9520 2.8000 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.6130 0.1550 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1560 0.4750 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 2.3600 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 1.3020 1.9260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5840 0.1270 1.5400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6840 -0.9590 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -1.5240 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 0.8110 2.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1380 -0.4370 2.8470 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2550 1.4090 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 1.9250 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5700 0.1440 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -0.9640 2.6090 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9060 -2.0720 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 -2.4450 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 -0.1680 2.7420 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2630 -1.2330 3.8200 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7220 -1.6390 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3520 -2.0400 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1160 -0.9130 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 -0.6200 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 2.0310 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.8100 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 1.9670 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -0.0830 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 -0.6510 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3630 -1.6420 4.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8850 0.3370 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.7550 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 -1.5760 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6120 -1.3720 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 0.7540 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 0.5810 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -0.3110 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 3.5700 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 3.2350 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 1.2450 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 1.9290 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 3.2190 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -0.5770 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -1.7750 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -2.3240 3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 -1.9490 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 2.1310 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 2.7540 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 2.3060 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 -1.8340 4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 -2.9700 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -3.2240 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -2.8400 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4230 -2.1890 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8960 -2.9610 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1230 -1.5400 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4470 0.1530 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.7330 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 0.8350 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 0.0510 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 1.7850 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 2.5360 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 1.2030 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 2.6380 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 -0.9560 4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 0.7320 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 0.2250 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 -1.4080 5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 0.2130 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 -0.3450 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9510 0.1110 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7100 1.1310 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5440 0.6620 2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -1.0060 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -1.6020 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -0.5220 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 -0.7910 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 -2.0530 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -2.3180 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0640 -2.2630 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4490 -0.5770 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6760 -1.6010 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 32 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 M END > 19 $$$$ 20 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 1.4120 2.8880 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 1.6790 -0.2370 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6670 0.5300 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 2.4960 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 1.4320 1.6640 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0870 0.2300 1.2090 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1710 -0.8840 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -1.3790 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 0.9910 1.8240 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5590 -0.2430 2.6930 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7120 1.7470 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 2.1430 2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 0.4260 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -0.7120 2.5760 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2410 -1.9890 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -2.1110 3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 0.3560 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -0.8930 4.6970 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4550 -1.0860 5.2430 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1020 0.2190 5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1420 1.2060 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7180 1.5750 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 2.0530 -0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 2.0740 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 0.0820 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 -0.8460 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -1.9500 6.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -1.0430 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 0.8180 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.7120 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 2.4800 4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8860 0.6080 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 0.7630 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -0.1650 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 3.6620 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 3.3060 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 1.3340 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 2.0830 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 3.3730 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -0.5380 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -1.7260 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -2.1930 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -1.7560 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 1.6600 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2870 2.5440 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 3.0150 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 2.4240 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -2.0970 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -2.8370 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 -3.0170 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3560 -2.1720 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0660 -1.5860 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5380 0.6560 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1220 0.0230 6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 2.1270 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 2.2210 4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 2.7560 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 2.6440 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 1.2970 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 2.7410 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -0.7790 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 0.9390 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 0.3150 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 -1.7580 6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3570 0.0170 6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -0.7620 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2280 -2.1310 6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 -0.1540 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 -1.3750 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -1.8350 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 0.8150 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.0520 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 1.7950 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.9310 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -1.5680 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.5120 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8880 2.2280 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9050 3.1910 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3410 2.9250 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 -0.3000 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9010 1.3300 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9080 0.3680 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 37 1 0 0 0 0 3 6 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 10 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 33 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 M END > 20 $$$$ 21 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 85 0 0 1 0 0 0 0 0999 V2000 1.2390 2.7370 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.4680 -0.2000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6690 0.3450 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 2.4440 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 1.4190 1.6470 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1150 0.1490 1.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2910 -0.9240 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -1.3200 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 1.0660 1.7710 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6390 -0.1120 2.6920 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6990 2.0110 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 2.2380 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 0.7040 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 -0.4840 2.5830 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4180 -1.7430 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -1.7760 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 0.6960 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 -0.5370 4.7370 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5520 -0.6390 5.2870 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1080 0.7020 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0850 1.7010 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6430 1.9720 4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 1.7460 -0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 2.0460 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 0.2740 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5260 -1.5160 6.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 -0.8000 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 3.3220 2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7150 3.0210 5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8830 1.1720 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 0.5870 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.9490 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -0.2360 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 0.8030 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -0.5480 5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.4900 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 3.1430 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 1.1330 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 2.0350 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 3.3620 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.5720 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -1.8150 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -2.0970 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -1.7220 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 1.9630 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 2.8520 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -1.8850 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -2.6030 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0090 -2.6740 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5450 -1.7980 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 -1.0880 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 1.0940 6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 0.5740 6.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 2.5430 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1490 2.5720 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 2.4280 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 2.5780 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 1.2640 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 2.7440 3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -0.5460 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 1.1660 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 0.4770 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 -1.6420 6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 0.0760 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5270 -1.0630 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 -1.6350 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7440 2.8410 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7040 3.7420 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1450 3.4150 5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 0.2330 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 1.9010 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9180 1.0060 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 0.5030 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.1550 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 1.5850 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.1390 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -1.7880 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.8280 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3570 -1.4510 6.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3770 0.3280 6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 -0.5310 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 28 2 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 18 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 M END > 21 $$$$ 22 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 142149 0 0 1 0 0 0 0 0999 V2000 2.7730 2.3580 -5.3240 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8280 1.2590 -4.8280 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5810 -0.0750 -4.8060 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8240 0.0650 -3.9220 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6440 1.1240 -4.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 2.4040 -4.4200 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4250 0.3610 -2.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 3.4590 -4.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 3.6190 -5.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 1.1600 -5.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -0.4220 -6.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 -0.2240 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 0.7420 3.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -1.2630 0.0660 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4540 -1.1690 -1.0160 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4770 0.2380 -1.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2760 1.2690 -0.5090 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2960 1.1060 0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 -0.1740 1.1140 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8210 -1.0780 -0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -2.1340 -2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 2.5860 -1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 7.4060 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 7.9800 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 5.0750 0.4280 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4230 3.9210 -0.4700 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8940 3.6120 -0.1760 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7270 4.8790 -0.3900 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2300 5.9210 0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 6.2860 0.1920 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6160 5.4210 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 2.7640 -0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 4.6120 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 7.7860 1.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 6.6750 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 5.6240 -0.5090 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3370 4.9640 -0.8730 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1770 7.7360 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5560 7.0820 -0.0710 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4270 5.9800 -1.1150 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7930 5.3450 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6730 6.4120 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5120 8.1520 -0.6020 C 0 0 2 0 0 0 0 0 0 0 0 0 11.8390 7.6300 -1.1300 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7390 10.2460 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7760 9.2270 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5250 10.0400 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5420 8.7620 -1.9000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.9600 8.3520 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7510 9.5390 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4430 11.1880 -1.4950 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8400 10.6510 -1.7990 C 0 0 2 0 0 0 0 0 0 0 0 0 15.6880 11.7820 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1440 12.6170 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7640 13.1420 -3.0670 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8710 11.9660 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 4.1980 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0200 6.5510 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7620 7.2470 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7770 12.0120 -1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9020 14.1140 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 3.9270 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 9.0020 -3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1360 13.8670 -4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4870 10.1240 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 2.8600 0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3530 13.8910 -0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6350 15.2280 -2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5190 11.8530 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 6.4980 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9760 8.6520 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 2.1420 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 1.5000 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -0.8520 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -0.8680 -3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 2.6600 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 4.4270 -4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 3.5230 -4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 3.1790 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 4.3680 -5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.4820 -5.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -1.2580 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 0.0000 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -1.2190 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 0.8200 3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4890 -2.2430 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -1.3590 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 0.4090 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 1.1220 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -0.3400 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5550 -1.1260 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -3.0480 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 8.6950 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 4.7710 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 4.2080 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 3.2780 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 5.1890 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 6.6140 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 6.1460 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 2.9090 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 7.1700 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 6.2200 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 6.0930 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 8.1750 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 8.5120 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2530 5.0080 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7040 4.4990 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6540 5.9700 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1960 6.6560 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7840 11.2120 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8280 9.7370 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1780 8.8170 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5170 7.9000 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8940 7.6010 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7620 9.2000 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2750 9.9090 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8110 13.4600 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0600 12.0070 -4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7750 11.3150 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8790 12.3420 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 4.9010 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 3.7040 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3090 3.4520 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 5.9430 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9140 5.9430 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 7.3880 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7450 6.9760 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8600 8.0940 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3370 6.3990 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 3.5330 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7070 4.3950 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 9.3780 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2910 9.7350 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6760 8.0660 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0350 13.1720 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1520 14.2440 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7740 14.6990 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4900 9.7600 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5450 10.9280 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8840 9.3090 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 2.2020 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6940 15.8220 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 72 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 73 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 74 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 75 1 0 0 0 0 5 6 1 0 0 0 0 6 8 1 0 0 0 0 6 76 1 0 0 0 0 7 16 1 0 0 0 0 8 77 1 0 0 0 0 8 78 1 0 0 0 0 8 79 1 0 0 0 0 9 80 1 0 0 0 0 10 81 1 0 0 0 0 11 82 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 83 1 0 0 0 0 12 84 1 0 0 0 0 13 85 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 14 86 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 87 1 0 0 0 0 16 17 1 0 0 0 0 16 88 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 89 1 0 0 0 0 18 19 1 0 0 0 0 19 90 1 0 0 0 0 20 91 1 0 0 0 0 21 92 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 23 34 2 0 0 0 0 24 93 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 31 1 0 0 0 0 25 94 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 95 1 0 0 0 0 27 28 1 0 0 0 0 27 96 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 97 1 0 0 0 0 29 30 1 0 0 0 0 30 98 1 0 0 0 0 31 99 1 0 0 0 0 32100 1 0 0 0 0 33 36 1 0 0 0 0 35 36 1 0 0 0 0 35 38 1 0 0 0 0 35101 1 0 0 0 0 35102 1 0 0 0 0 36 37 1 0 0 0 0 36103 1 0 0 0 0 37 40 1 0 0 0 0 37 57 1 0 0 0 0 37 62 1 0 0 0 0 38 39 1 0 0 0 0 38104 1 0 0 0 0 38105 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 39 58 1 0 0 0 0 40 41 1 0 0 0 0 40 70 1 0 0 0 0 41 42 1 0 0 0 0 41106 1 0 0 0 0 41107 1 0 0 0 0 42 44 1 0 0 0 0 42108 1 0 0 0 0 42109 1 0 0 0 0 43 44 1 0 0 0 0 43 46 1 0 0 0 0 43 71 1 0 0 0 0 44 48 1 0 0 0 0 44 59 1 0 0 0 0 45 46 1 0 0 0 0 45 47 2 0 0 0 0 45110 1 0 0 0 0 46111 1 0 0 0 0 46112 1 0 0 0 0 47 48 1 0 0 0 0 47 51 1 0 0 0 0 48 49 1 0 0 0 0 48 63 1 0 0 0 0 49 50 1 0 0 0 0 49113 1 0 0 0 0 49114 1 0 0 0 0 50 52 1 0 0 0 0 50115 1 0 0 0 0 50116 1 0 0 0 0 51 52 1 0 0 0 0 51 56 1 0 0 0 0 51 69 1 0 0 0 0 52 53 1 0 0 0 0 52 65 1 0 0 0 0 53 54 1 0 0 0 0 53 60 2 0 0 0 0 54 55 1 0 0 0 0 54117 1 0 0 0 0 54118 1 0 0 0 0 55 56 1 0 0 0 0 55 61 1 0 0 0 0 55 64 1 0 0 0 0 56119 1 0 0 0 0 56120 1 0 0 0 0 57121 1 0 0 0 0 57122 1 0 0 0 0 57123 1 0 0 0 0 58124 1 0 0 0 0 58125 1 0 0 0 0 58126 1 0 0 0 0 59127 1 0 0 0 0 59128 1 0 0 0 0 59129 1 0 0 0 0 61 67 2 0 0 0 0 61 68 1 0 0 0 0 62 66 1 0 0 0 0 62130 1 0 0 0 0 62131 1 0 0 0 0 63132 1 0 0 0 0 63133 1 0 0 0 0 63134 1 0 0 0 0 64135 1 0 0 0 0 64136 1 0 0 0 0 64137 1 0 0 0 0 65138 1 0 0 0 0 65139 1 0 0 0 0 65140 1 0 0 0 0 66141 1 0 0 0 0 68142 1 0 0 0 0 M END > 22 $$$$ 23 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0430 1.6970 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.1420 -0.3160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9740 1.2360 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.0940 0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.2000 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -0.6080 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -1.9860 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -2.5490 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -1.7330 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.3640 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 2.0500 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.5740 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 4.5020 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 5.9080 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 6.2910 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 5.3530 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 3.9520 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 3.1090 2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 6.7490 -0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 5.7010 2.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 7.5820 1.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -3.8960 -1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -2.2810 -2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -4.6710 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -1.3830 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 8.5400 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 5.1660 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 1.9800 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 2.1820 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 1.5830 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 1.2560 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -2.6180 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 0.2690 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 4.2230 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -5.7260 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -4.3590 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -4.5180 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -0.8380 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -0.6770 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -1.9480 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 8.4900 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 8.3220 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 9.5400 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 5.5940 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 4.0820 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 5.4130 4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 20 27 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END > 23 $$$$ 24 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.1290 1.4700 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.9740 0.0730 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3440 1.3390 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -0.0720 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.0300 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -0.7140 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.1000 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7920 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.0990 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.7230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.6850 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 3.4750 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 4.2280 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 5.7000 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 6.3430 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 5.5820 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 4.1130 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 3.4280 2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 6.3810 -1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 6.1690 2.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 7.6950 0.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.1450 0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -2.7720 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -4.9280 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -1.9950 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 8.4390 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 5.9290 3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7760 1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -2.9160 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.9290 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.7380 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 1.7440 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 1.5500 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.1860 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 3.7580 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -4.6340 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -4.7630 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -5.9840 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -2.6530 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -1.2740 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -1.4660 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 8.3200 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 8.0710 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 9.4940 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 6.3990 4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 4.8550 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 6.3480 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -3.5250 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.3990 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -1.9320 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 34 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 20 27 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END > 24 $$$$ 25 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.1300 1.4700 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.9740 0.0720 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3440 1.3390 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -0.0720 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.0290 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.7140 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.1000 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7920 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.0990 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.7230 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.6840 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 3.4750 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 4.2270 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 5.7000 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 6.3430 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 5.5820 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 4.1130 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 3.4280 2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 6.3810 -1.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 6.1700 2.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 7.6950 0.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.1450 0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -2.7720 -0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -4.9280 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 8.4390 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 5.9290 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7760 1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -2.9160 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.9290 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.7380 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 1.7440 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 1.5500 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.1860 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 3.7580 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -2.8720 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -5.9840 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -4.6340 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -4.7640 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 8.3200 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 8.0710 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 9.4940 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 6.4000 4.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 4.8550 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 6.3480 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -3.5250 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.3990 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -1.9320 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 20 26 1 0 0 0 0 21 25 1 0 0 0 0 22 24 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END > 25 $$$$ 26 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3860 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6770 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0910 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0260 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -0.7470 -0.0500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8530 0.1610 0.3860 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7510 1.4780 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 2.1360 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 -0.5080 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 0.3600 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -0.8460 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 -1.4610 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -0.7780 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -0.4410 2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0080 -1.7920 -2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 -1.3950 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5930 -1.7390 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 -2.3440 -0.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8890 -1.4920 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -2.9280 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1510 -1.6610 1.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.0530 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7020 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -2.1280 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 2.3640 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 3.4520 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 4.1060 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -1.8600 0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -1.1080 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.7570 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 2.1120 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 1.2700 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -0.6300 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 -1.1350 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -1.0970 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6580 -0.8860 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0830 -0.8400 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7710 -2.1000 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7840 -3.0110 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0370 -3.0140 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 -3.7250 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -2.4510 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -2.4600 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -2.5590 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 2.9930 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 2.8940 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.4410 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 3.8260 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.8060 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 5.1860 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.4810 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 6 2 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END > 26 $$$$ 27 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 1.5430 2.7550 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 1.5530 -0.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7950 0.3980 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 2.3530 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 1.2850 1.7930 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2180 0.0890 1.3590 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3110 -1.0060 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -1.5280 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 0.8340 1.9190 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7350 -0.4120 2.7660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8040 1.5000 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 1.9740 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 0.2440 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 -0.8950 2.5880 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5200 -1.9990 3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 -2.3020 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 -0.0190 2.8410 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8120 -1.0480 3.9610 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2940 -1.3660 4.1540 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9210 -1.8600 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7550 -0.8250 1.7430 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2660 -0.5200 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5240 0.4510 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2980 -1.4050 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4280 -2.3790 5.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 -1.4970 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -0.3250 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 0.6870 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -0.4480 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 0.9210 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -0.0750 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 1.9220 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -0.8380 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.9360 -0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5850 -1.7780 0.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5740 -1.5340 -0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 0.6210 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 3.5350 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 3.1690 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.2110 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.9450 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 3.2240 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -0.6420 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -1.8410 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.3340 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -1.9330 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 2.2440 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 2.8080 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 2.3370 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -1.8050 4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -2.9220 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2050 -3.0680 4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3410 -2.6910 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8110 -0.4690 4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9860 -2.0450 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4490 -2.7980 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 -1.4470 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 0.2310 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5840 0.2180 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3920 1.1740 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1480 0.8720 3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3430 -2.6360 5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 -0.7100 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 -1.9500 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -2.2570 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 0.6870 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0810 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 1.6630 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 -1.1780 6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 0.4480 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2340 -0.1890 5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 -0.9430 4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 0.7620 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 0.1940 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 2.4700 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 1.1430 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 2.6070 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -1.0550 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -1.6960 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -0.6310 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 2.6440 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8870 -2.1430 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 28 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 37 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 35 1 0 0 0 0 24 36 2 0 0 0 0 25 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 34 81 1 0 0 0 0 35 82 1 0 0 0 0 M END > 27 $$$$ 28 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.3560 1.1910 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -0.1990 0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 3.4570 -0.1120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0270 4.2110 -0.1450 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8680 3.6870 -1.3130 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0590 2.1760 -1.1560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7810 1.5390 -1.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.9550 -0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0700 3.8870 1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 5.6080 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 4.3320 -1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 1.6430 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8390 0.5620 -1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0610 1.0520 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 1.3960 -0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 0.4010 -3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 0.7820 -3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 1.2780 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 1.5120 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 1.0200 -4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 0.6560 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 1.2130 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9600 -0.0360 -4.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 0.1760 -5.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 0.8970 -5.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 1.8660 -3.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 2.0210 -6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 0.8200 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 1.7140 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 1.8620 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 1.5150 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 1.0160 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9840 0.8600 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3030 1.6620 4.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 1.3260 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.5720 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -0.7460 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 3.6590 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 4.0490 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 3.8940 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 1.9720 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 1.7490 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 4.8320 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 6.0050 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 5.2940 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 0.2980 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 0.8590 -6.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 2.9010 -6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 2.2020 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 1.8170 -7.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 0.1420 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 0.2710 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.2500 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 1.9850 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 2.2500 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5640 0.7480 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 0.4720 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 0.8840 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 24 1 0 0 0 0 22 29 1 0 0 0 0 22 33 2 0 0 0 0 24 47 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END > 28 $$$$ 29 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 75 79 0 0 1 0 0 0 0 0999 V2000 0.8260 1.7540 -0.4820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 0.2200 -0.6670 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2870 -0.1940 -0.4080 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8280 0.8610 0.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 2.0860 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.1220 -1.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 2.1580 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 3.5790 0.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 2.4060 -1.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -1.4420 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -4.7810 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -5.6020 2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4170 -3.4460 -0.4850 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0310 -2.8410 -0.7260 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6580 -1.9550 0.4660 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7120 -2.7890 1.7490 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0180 -3.3480 1.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -4.2230 0.8340 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7440 -4.3320 -1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -2.0530 -1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -1.9100 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0020 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -0.1820 4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -0.2700 5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -2.0080 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -1.1870 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.3140 5.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -2.2670 4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -3.0180 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.8850 3.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -4.0060 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.6240 6.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 0.5260 6.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 0.7060 4.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 2.0150 4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -0.9090 2.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -1.6350 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -4.7920 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -5.7140 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -5.8630 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -5.0830 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -4.1630 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -6.7730 1.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.2500 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -0.2590 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 2.3700 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 2.8840 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -1.0730 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 1.8320 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 1.6890 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 3.9070 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 3.3710 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 -3.9570 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -5.3760 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 -5.9900 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 -2.6490 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 -3.6400 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -1.1270 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -3.5920 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -5.0450 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 -4.7520 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -2.5500 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -2.3980 5.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 1.3710 5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 2.5060 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 2.5990 4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 1.9390 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 -1.2130 4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -2.6810 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5050 -1.5640 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -4.6760 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -6.3220 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -5.2020 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -3.5580 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -7.6500 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 51 1 0 0 0 0 9 52 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 53 1 0 0 0 0 11 54 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 18 60 1 0 0 0 0 19 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 34 1 0 0 0 0 24 26 1 0 0 0 0 24 33 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 38 1 0 0 0 0 31 42 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 38 39 2 0 0 0 0 38 71 1 0 0 0 0 39 40 1 0 0 0 0 39 72 1 0 0 0 0 40 41 2 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 41 73 1 0 0 0 0 42 74 1 0 0 0 0 43 75 1 0 0 0 0 M END > 29 $$$$ 30 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 79 84 0 0 1 0 0 0 0 0999 V2000 1.8130 3.2150 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 2.1430 -0.4930 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6550 1.0130 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 2.5960 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 1.5230 1.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9580 0.4770 1.0620 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7650 -0.6130 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -1.3670 2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 0.8120 1.8010 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2120 -0.4180 2.6920 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5300 1.0760 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 1.7640 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -0.2030 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 -1.1450 2.5780 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5840 -2.4080 3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 -3.0950 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 -0.7520 3.9580 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1280 -2.1750 3.5960 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0940 -2.2300 2.4140 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3940 -1.4690 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8250 -0.0190 2.7210 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9550 0.1720 3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 -0.1130 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5480 -1.3920 1.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 0.8060 0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -1.5240 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 0.4780 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 2.7270 -0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.4740 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 2.2130 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -0.0430 4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3510 -0.7810 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 -2.7610 4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9200 1.0440 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.1190 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -0.0180 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 3.9900 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 3.6850 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.7240 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 2.1360 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 3.3700 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -0.2040 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -1.3310 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -2.1400 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -1.8450 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 1.7130 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 2.2710 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 2.5200 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -2.1790 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 -3.1040 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -3.8400 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -3.6280 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 -3.2530 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8060 -1.7040 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 -1.6110 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 1.2150 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5670 -0.0540 4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 -0.6230 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 -2.0370 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 -2.1840 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 3.4350 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 1.6460 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.7070 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.4000 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 2.8620 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 1.4630 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 2.8100 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -0.9210 4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 0.7380 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 0.3210 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 -3.7860 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7420 -2.1580 5.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 -2.7510 5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4930 0.8560 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4620 2.0320 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5840 1.0000 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -0.4520 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -0.9560 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 0.2520 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 29 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 27 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 34 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 35 79 1 0 0 0 0 M END > 30 $$$$ 31 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 100106 0 0 1 0 0 0 0 0999 V2000 -0.6980 1.9510 -0.7500 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7650 0.4600 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.1940 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 1.0390 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 2.2810 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 2.4200 -0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 3.1490 -2.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 2.5020 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 0.7280 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 8.4460 11.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 7.9960 10.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 9.9760 12.3860 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0960 10.8800 12.0270 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1180 10.0700 11.2230 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4340 9.4870 9.9840 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3240 8.6820 10.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 9.3980 11.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0810 10.7400 13.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 11.3670 13.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 10.9210 10.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 8.6840 9.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 6.8280 8.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 8.1820 8.0190 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0150 8.0390 7.0220 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6040 6.2980 6.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 6.2290 5.9070 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4570 7.5600 5.6820 C 0 0 1 0 0 0 0 0 0 0 0 0 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0 0 0 0 -0.0440 1.5000 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 4.1000 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.1080 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 0.1440 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -0.7090 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.1440 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.1690 -4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -0.3520 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 7.5890 12.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 8.9690 12.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 7.3880 10.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 9.1640 13.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 11.7200 11.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 9.2590 11.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 10.2990 9.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 10.2080 10.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 11.1420 13.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 11.9470 13.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 10.4730 10.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 6.9400 8.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 6.1200 8.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 8.8820 7.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 6.9720 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 5.3020 7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 6.5060 5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 8.2150 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 6.9100 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 7.5820 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 5.0580 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 3.2940 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 4.5840 5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 3.2600 5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 4.4360 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 6.0380 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 3.6380 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 5.1110 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 1.7220 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 3.1000 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 2.5730 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 1.8880 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 4.2120 6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 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16 1 0 0 0 0 15 21 1 0 0 0 0 15 63 1 0 0 0 0 16 17 1 0 0 0 0 17 64 1 0 0 0 0 18 65 1 0 0 0 0 19 66 1 0 0 0 0 20 67 1 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 24 1 0 0 0 0 23 70 1 0 0 0 0 24 27 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 31 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 42 1 0 0 0 0 31 35 1 0 0 0 0 31 41 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35 48 1 0 0 0 0 36 37 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 38 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 38 39 1 0 0 0 0 38 50 1 0 0 0 0 39 49 1 0 0 0 0 39 85 1 0 0 0 0 40 86 1 0 0 0 0 40 87 1 0 0 0 0 40 88 1 0 0 0 0 42 89 1 0 0 0 0 42 90 1 0 0 0 0 43 91 1 0 0 0 0 43 92 1 0 0 0 0 43 93 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45 94 1 0 0 0 0 48 95 1 0 0 0 0 48 96 1 0 0 0 0 48 97 1 0 0 0 0 49 98 1 0 0 0 0 49 99 1 0 0 0 0 49100 1 0 0 0 0 M END > 31 $$$$ 32 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 123130 0 0 1 0 0 0 0 0999 V2000 -0.2460 2.1290 -0.7590 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3200 0.7120 -0.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3330 0.4660 -1.7440 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3640 1.4530 -1.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 2.7940 -1.8450 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9100 3.1340 -0.7280 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9060 -0.8340 -1.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 3.7570 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 3.5150 -2.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 4.4540 -0.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 2.3940 0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.8780 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -1.2740 -2.7260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5290 -2.7900 -2.8720 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6490 -1.4710 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0 46107 1 0 0 0 0 47108 1 0 0 0 0 47109 1 0 0 0 0 47110 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 49 54 1 0 0 0 0 49 56 1 0 0 0 0 49111 1 0 0 0 0 50 51 1 0 0 0 0 50 57 1 0 0 0 0 50112 1 0 0 0 0 51 52 1 0 0 0 0 51113 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 53 58 1 0 0 0 0 53114 1 0 0 0 0 54 55 1 0 0 0 0 54115 1 0 0 0 0 55116 1 0 0 0 0 56117 1 0 0 0 0 57118 1 0 0 0 0 58 59 1 0 0 0 0 58119 1 0 0 0 0 58120 1 0 0 0 0 59121 1 0 0 0 0 M END > 33 $$$$ 34 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 120127 0 0 1 0 0 0 0 0999 V2000 0.1800 1.5520 0.1660 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4430 0.0550 0.3560 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3420 -0.4450 -0.7770 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5590 0.3060 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.7060 -1.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5200 2.2930 0.1180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6380 -1.8280 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 2.3890 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 3.6960 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 3.6810 -0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 2.0440 1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -2.3920 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -2.4670 -1.7080 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7750 -3.9220 -1.7800 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1880 -3.0330 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -4.5000 -0.2460 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2700 -4.7480 -0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9460 -6.2140 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -7.0500 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -5.5970 -0.3940 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3630 -6.9870 -0.8890 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2420 -6.1750 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -5.1080 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 -7.5460 -1.0440 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4310 -7.5450 -1.7850 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3020 -9.0480 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 -8.3240 -2.0220 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7350 -9.4110 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8310 -8.9810 -1.2600 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7150 -9.7550 -2.2410 C 0 0 2 0 0 0 0 0 0 0 0 0 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H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -1.2590 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -3.7430 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -3.4790 4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2410 -1.9160 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -0.2960 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -3.4750 5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -4.0140 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -3.0400 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 1 62 1 0 0 0 0 2 3 1 0 0 0 0 2 49 1 0 0 0 0 2 63 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 64 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 65 1 0 0 0 0 6 10 1 0 0 0 0 6 66 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 48 2 0 0 0 0 9 67 1 0 0 0 0 10 68 1 0 0 0 0 11 69 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 70 1 0 0 0 0 12 71 1 0 0 0 0 13 14 1 0 0 0 0 13 72 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 73 1 0 0 0 0 15 74 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 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0 0 47107 1 0 0 0 0 47108 1 0 0 0 0 47109 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 50 55 1 0 0 0 0 50 57 1 0 0 0 0 50110 1 0 0 0 0 51 52 1 0 0 0 0 51 58 1 0 0 0 0 51111 1 0 0 0 0 52 53 1 0 0 0 0 52112 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54 59 1 0 0 0 0 54113 1 0 0 0 0 55 56 1 0 0 0 0 55114 1 0 0 0 0 56115 1 0 0 0 0 57116 1 0 0 0 0 58117 1 0 0 0 0 59 60 1 0 0 0 0 59118 1 0 0 0 0 59119 1 0 0 0 0 60120 1 0 0 0 0 M END > 34 $$$$ 35 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 120127 0 0 1 0 0 0 0 0999 V2000 -0.4340 2.1780 -0.6710 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1620 0.7720 -0.5470 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1450 0.5400 -1.6980 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1600 1.5460 -1.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 2.8780 -1.8250 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7040 3.2040 -0.6800 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7470 -0.7480 -1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 3.8620 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 3.6320 -2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 4.5140 -0.8670 O 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 -2.4630 -2.2800 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 0.2290 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -1.0900 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -3.6620 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -3.7560 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -3.1260 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -0.2310 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -3.7710 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 1 62 1 0 0 0 0 2 3 1 0 0 0 0 2 48 1 0 0 0 0 2 63 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 64 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 65 1 0 0 0 0 6 10 1 0 0 0 0 6 66 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 67 1 0 0 0 0 8 68 1 0 0 0 0 9 69 1 0 0 0 0 10 70 1 0 0 0 0 11 71 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 72 1 0 0 0 0 12 73 1 0 0 0 0 13 14 1 0 0 0 0 13 74 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 75 1 0 0 0 0 15 76 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 77 1 0 0 0 0 18 19 1 0 0 0 0 18 78 1 0 0 0 0 18 79 1 0 0 0 0 19 21 1 0 0 0 0 19 80 1 0 0 0 0 19 81 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 39 1 0 0 0 0 21 25 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 82 1 0 0 0 0 22 83 1 0 0 0 0 23 84 1 0 0 0 0 23 85 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 28 1 0 0 0 0 26 86 1 0 0 0 0 26 87 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 61 1 0 0 0 0 28 88 1 0 0 0 0 28 89 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 90 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 30 42 1 0 0 0 0 31 44 1 0 0 0 0 31 91 1 0 0 0 0 31 92 1 0 0 0 0 32 33 1 0 0 0 0 32 44 2 0 0 0 0 32 45 1 0 0 0 0 33 34 1 0 0 0 0 33 43 2 0 0 0 0 35 93 1 0 0 0 0 35 94 1 0 0 0 0 35 95 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 96 1 0 0 0 0 39 97 1 0 0 0 0 39 98 1 0 0 0 0 41 99 1 0 0 0 0 41100 1 0 0 0 0 41101 1 0 0 0 0 44102 1 0 0 0 0 45103 1 0 0 0 0 45104 1 0 0 0 0 45105 1 0 0 0 0 46106 1 0 0 0 0 46107 1 0 0 0 0 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0 0 6.3930 2.3860 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 4.0970 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 4.9260 -5.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 3.6880 -4.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.2320 0.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.4610 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 3.7700 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 1.5790 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 2.5260 -2.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 2.3240 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 2.2490 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.3750 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 1.4650 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 3.2890 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 3.9750 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 1.3860 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 3.0140 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 2.3270 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 5.1390 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.4960 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -0.0130 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -0.4350 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 4.1170 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 4.0290 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 4.2470 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 0.4970 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 1.8400 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 1.9200 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 2.2920 -3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 15 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 M END > 36 $$$$ 37 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 76 82 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4660 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3780 2.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 1.9800 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -0.1280 2.3980 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2620 0.5600 1.7510 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4030 0.3240 2.7480 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7910 -0.5980 3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -1.1330 3.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2050 -0.7140 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -1.8170 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.7500 -0.7860 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3040 -2.0210 0.1050 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3780 -1.3410 -2.0770 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7090 -3.1370 -0.7560 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1180 -2.6950 -2.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9480 -3.5610 -3.3260 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2130 -4.4300 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -5.4530 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -4.9130 -1.0610 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0480 -4.5660 -0.4750 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1890 -4.8370 0.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -5.8830 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -6.0240 -0.1020 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0450 -6.6020 2.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -5.7930 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -4.4130 -3.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -2.7080 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -2.1770 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -0.1630 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -2.7910 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.9070 1.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 1.9510 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -0.8180 4.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -0.2460 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -2.4610 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -1.8270 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.8880 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -3.7020 -0.1160 C 0 0 0 0 0 0 0 0 0 0 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-4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -3.3570 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -2.0480 -4.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -2.4160 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.9040 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -3.7580 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 2.8680 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 1.5670 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 3.0410 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 1.5920 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -1.3770 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -4.5040 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -3.0610 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -4.1290 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 0.2780 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -0.5160 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -1.3160 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 5 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 34 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 24 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 37 38 2 0 0 0 0 37 70 1 0 0 0 0 38 39 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 40 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 M END > 37 $$$$ 38 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 150156 0 0 1 0 0 0 0 0999 V2000 -0.1270 3.1100 -2.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0940 1.5940 -2.5110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2680 1.2530 -1.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4330 1.9570 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.3800 -1.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1690 3.8070 -2.9290 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3900 1.1620 -3.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 3.4450 -3.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 4.0240 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 5.2230 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.6370 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.2600 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 1.4260 3.1160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1260 1.8340 4.5140 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8300 1.0860 4.8400 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2120 1.3920 3.7610 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3050 1.0170 2.4820 O 0 0 0 0 0 0 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0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 68 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 69 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 70 1 0 0 0 0 6 10 1 0 0 0 0 6 71 1 0 0 0 0 7 72 1 0 0 0 0 8 73 1 0 0 0 0 9 74 1 0 0 0 0 9 75 1 0 0 0 0 9 76 1 0 0 0 0 10 77 1 0 0 0 0 11 12 1 0 0 0 0 12 18 1 0 0 0 0 12 78 1 0 0 0 0 12 79 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 80 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 81 1 0 0 0 0 15 16 1 0 0 0 0 15 56 1 0 0 0 0 15 82 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 83 1 0 0 0 0 17 18 1 0 0 0 0 18 84 1 0 0 0 0 19 85 1 0 0 0 0 20 86 1 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 87 1 0 0 0 0 22 88 1 0 0 0 0 23 24 1 0 0 0 0 23 89 1 0 0 0 0 24 27 1 0 0 0 0 24 90 1 0 0 0 0 24 91 1 0 0 0 0 25 26 1 0 0 0 0 25 92 1 0 0 0 0 25 93 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 94 1 0 0 0 0 28 95 1 0 0 0 0 29 31 1 0 0 0 0 29 96 1 0 0 0 0 29 97 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 98 1 0 0 0 0 31 35 1 0 0 0 0 31 99 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32100 1 0 0 0 0 32101 1 0 0 0 0 33102 1 0 0 0 0 33103 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35104 1 0 0 0 0 36 37 1 0 0 0 0 36105 1 0 0 0 0 36106 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 37107 1 0 0 0 0 38 41 1 0 0 0 0 38 66 1 0 0 0 0 39108 1 0 0 0 0 39109 1 0 0 0 0 39110 1 0 0 0 0 40111 1 0 0 0 0 40112 1 0 0 0 0 40113 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41114 1 0 0 0 0 42 44 1 0 0 0 0 42 51 2 0 0 0 0 43115 1 0 0 0 0 43116 1 0 0 0 0 43117 1 0 0 0 0 44 45 1 0 0 0 0 44118 1 0 0 0 0 44119 1 0 0 0 0 45 46 1 0 0 0 0 45120 1 0 0 0 0 45121 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46122 1 0 0 0 0 47 49 1 0 0 0 0 47123 1 0 0 0 0 47124 1 0 0 0 0 48125 1 0 0 0 0 48126 1 0 0 0 0 48127 1 0 0 0 0 49 52 1 0 0 0 0 49128 1 0 0 0 0 50129 1 0 0 0 0 52 53 2 0 0 0 0 52 54 1 0 0 0 0 54130 1 0 0 0 0 54131 1 0 0 0 0 54132 1 0 0 0 0 56 60 1 0 0 0 0 57 58 1 0 0 0 0 57 62 1 0 0 0 0 57 63 1 0 0 0 0 57133 1 0 0 0 0 58 59 1 0 0 0 0 58 64 1 0 0 0 0 58134 1 0 0 0 0 59 60 1 0 0 0 0 59 65 1 0 0 0 0 59135 1 0 0 0 0 60 61 1 0 0 0 0 60136 1 0 0 0 0 61 62 1 0 0 0 0 62137 1 0 0 0 0 62138 1 0 0 0 0 63139 1 0 0 0 0 64140 1 0 0 0 0 65141 1 0 0 0 0 M END > 39 $$$$ 40 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 139145 0 0 1 0 0 0 0 0999 V2000 -0.1270 3.1100 -2.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0940 1.5940 -2.5110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2680 1.2530 -1.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4330 1.9570 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.3800 -1.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1690 3.8070 -2.9290 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3900 1.1620 -3.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 3.4450 -3.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 4.0240 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 5.2230 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.6370 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.2600 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 1.4260 3.1160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1260 1.8340 4.5140 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8300 1.0860 4.8400 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2120 1.3920 3.7610 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3050 1.0170 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 1.7190 2.1030 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7700 2.1730 2.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 1.4970 5.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 0.6530 4.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 0.0190 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.9520 3.1400 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8150 0.7670 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 0.3030 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 0.1430 1.7140 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9610 1.0850 2.9150 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3020 1.0120 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4350 1.3790 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 0.4650 0.7780 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8260 1.6980 1.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7920 0.9930 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 0.6540 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0700 1.2670 -0.8630 C 0 0 1 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 -12.1740 0.4720 -4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8160 0.9190 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4670 3.1430 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8250 2.6960 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0350 1.1840 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6920 3.5000 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2160 3.0790 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9620 1.0200 -6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6850 -0.1810 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3280 0.0820 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6510 4.6090 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.5610 5.4890 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.0940 6.6770 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1320 7.4020 -3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.8060 3.7930 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.8940 3.6350 -7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4890 1.6950 -5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4920 3.4420 -6.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7500 5.4440 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -22.2500 4.8330 -6.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.3770 1.7630 -7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2090 0.5740 -6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.0780 6.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 66 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 67 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 68 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 69 1 0 0 0 0 6 10 1 0 0 0 0 6 70 1 0 0 0 0 7 71 1 0 0 0 0 8 72 1 0 0 0 0 9 73 1 0 0 0 0 9 74 1 0 0 0 0 9 75 1 0 0 0 0 10 76 1 0 0 0 0 11 12 1 0 0 0 0 12 18 1 0 0 0 0 12 77 1 0 0 0 0 12 78 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 79 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 80 1 0 0 0 0 15 16 1 0 0 0 0 15 64 1 0 0 0 0 15 81 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 82 1 0 0 0 0 17 18 1 0 0 0 0 18 83 1 0 0 0 0 19 84 1 0 0 0 0 20 85 1 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 86 1 0 0 0 0 22 87 1 0 0 0 0 23 24 1 0 0 0 0 23 88 1 0 0 0 0 24 27 1 0 0 0 0 24 89 1 0 0 0 0 24 90 1 0 0 0 0 25 26 1 0 0 0 0 25 91 1 0 0 0 0 25 92 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 93 1 0 0 0 0 28 94 1 0 0 0 0 29 31 1 0 0 0 0 29 95 1 0 0 0 0 29 96 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 97 1 0 0 0 0 31 35 1 0 0 0 0 31 98 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 99 1 0 0 0 0 32100 1 0 0 0 0 33101 1 0 0 0 0 33102 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35103 1 0 0 0 0 36 37 1 0 0 0 0 36104 1 0 0 0 0 36105 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 37106 1 0 0 0 0 38 41 1 0 0 0 0 38 65 1 0 0 0 0 39107 1 0 0 0 0 39108 1 0 0 0 0 39109 1 0 0 0 0 40110 1 0 0 0 0 40111 1 0 0 0 0 40112 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41113 1 0 0 0 0 42 44 1 0 0 0 0 42 51 2 0 0 0 0 43114 1 0 0 0 0 43115 1 0 0 0 0 43116 1 0 0 0 0 44 45 1 0 0 0 0 44117 1 0 0 0 0 44118 1 0 0 0 0 45 46 1 0 0 0 0 45119 1 0 0 0 0 45120 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46121 1 0 0 0 0 47 49 1 0 0 0 0 47122 1 0 0 0 0 47123 1 0 0 0 0 48124 1 0 0 0 0 48125 1 0 0 0 0 48126 1 0 0 0 0 49 58 1 0 0 0 0 50127 1 0 0 0 0 53 54 1 0 0 0 0 53 60 1 0 0 0 0 53128 1 0 0 0 0 53129 1 0 0 0 0 54130 1 0 0 0 0 55 56 1 0 0 0 0 55 60 1 0 0 0 0 55 61 1 0 0 0 0 55131 1 0 0 0 0 56 57 1 0 0 0 0 56 62 1 0 0 0 0 56132 1 0 0 0 0 57 58 1 0 0 0 0 57 63 1 0 0 0 0 57133 1 0 0 0 0 58 59 1 0 0 0 0 58134 1 0 0 0 0 59 60 1 0 0 0 0 60135 1 0 0 0 0 61136 1 0 0 0 0 62137 1 0 0 0 0 63138 1 0 0 0 0 64139 1 0 0 0 0 M END > 40 $$$$ 41 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 139145 0 0 1 0 0 0 0 0999 V2000 5.1730 2.1470 2.0800 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5330 0.9940 1.3010 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4020 -0.2220 2.2220 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6910 -0.5780 2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 0.4450 3.5010 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5260 1.6880 2.6320 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3560 0.6590 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 3.2630 1.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 -0.0560 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 2.7320 3.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 0.0980 3.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -1.0070 4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -1.7000 6.2930 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1440 -1.2570 7.3840 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1690 -0.8180 6.7280 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1210 0.2970 5.7190 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0620 -0.1720 4.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -0.5520 5.3010 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3770 -2.0430 6.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -2.3470 8.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 0.6720 5.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 1.7900 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 1.8480 4.2590 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2150 3.0960 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 1.6670 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 2.6580 4.6790 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5800 3.6520 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 4.9210 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 5.5640 4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 3.3580 4.4820 C 0 0 3 0 0 0 0 0 0 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1 0 0 0 0 22 87 1 0 0 0 0 23 24 1 0 0 0 0 23 88 1 0 0 0 0 24 27 1 0 0 0 0 24 89 1 0 0 0 0 24 90 1 0 0 0 0 25 26 1 0 0 0 0 25 91 1 0 0 0 0 25 92 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 39 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 93 1 0 0 0 0 29 31 1 0 0 0 0 29 94 1 0 0 0 0 29 95 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 96 1 0 0 0 0 31 35 1 0 0 0 0 31 97 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 98 1 0 0 0 0 32 99 1 0 0 0 0 33100 1 0 0 0 0 33101 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35102 1 0 0 0 0 36 37 1 0 0 0 0 36103 1 0 0 0 0 36104 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 37105 1 0 0 0 0 38 41 1 0 0 0 0 38 55 1 0 0 0 0 39106 1 0 0 0 0 39107 1 0 0 0 0 39108 1 0 0 0 0 40109 1 0 0 0 0 40110 1 0 0 0 0 40111 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41112 1 0 0 0 0 42 44 1 0 0 0 0 42 51 2 0 0 0 0 43113 1 0 0 0 0 43114 1 0 0 0 0 43115 1 0 0 0 0 44 45 1 0 0 0 0 44116 1 0 0 0 0 44117 1 0 0 0 0 45 46 1 0 0 0 0 45118 1 0 0 0 0 45119 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46120 1 0 0 0 0 47 49 1 0 0 0 0 47121 1 0 0 0 0 47122 1 0 0 0 0 48123 1 0 0 0 0 48124 1 0 0 0 0 48125 1 0 0 0 0 49 52 1 0 0 0 0 49126 1 0 0 0 0 50127 1 0 0 0 0 52 53 2 0 0 0 0 52 54 1 0 0 0 0 54128 1 0 0 0 0 54129 1 0 0 0 0 54130 1 0 0 0 0 56 57 1 0 0 0 0 56 61 1 0 0 0 0 56 63 1 0 0 0 0 56131 1 0 0 0 0 57 58 1 0 0 0 0 57 64 1 0 0 0 0 57132 1 0 0 0 0 58 59 1 0 0 0 0 58 65 1 0 0 0 0 58133 1 0 0 0 0 59 60 1 0 0 0 0 59 62 1 0 0 0 0 59134 1 0 0 0 0 60 61 1 0 0 0 0 61135 1 0 0 0 0 61136 1 0 0 0 0 63137 1 0 0 0 0 64138 1 0 0 0 0 65139 1 0 0 0 0 M END > 41 $$$$ 42 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 133138 0 0 1 0 0 0 0 0999 V2000 -0.1270 3.1100 -2.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0940 1.5940 -2.5110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2680 1.2530 -1.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4330 1.9570 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.3800 -1.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1690 3.8070 -2.9290 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3900 1.1620 -3.8410 O 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0 0 37109 1 0 0 0 0 38 41 1 0 0 0 0 38 68 1 0 0 0 0 39110 1 0 0 0 0 39111 1 0 0 0 0 39112 1 0 0 0 0 40113 1 0 0 0 0 40114 1 0 0 0 0 40115 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41116 1 0 0 0 0 42 44 1 0 0 0 0 42 51 2 0 0 0 0 43117 1 0 0 0 0 43118 1 0 0 0 0 43119 1 0 0 0 0 44 45 1 0 0 0 0 44120 1 0 0 0 0 44121 1 0 0 0 0 45 46 1 0 0 0 0 45122 1 0 0 0 0 45123 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46124 1 0 0 0 0 47 49 1 0 0 0 0 47125 1 0 0 0 0 47126 1 0 0 0 0 48127 1 0 0 0 0 48128 1 0 0 0 0 48129 1 0 0 0 0 49 52 1 0 0 0 0 49130 1 0 0 0 0 50131 1 0 0 0 0 52 53 2 0 0 0 0 52 54 1 0 0 0 0 54 56 1 0 0 0 0 54132 1 0 0 0 0 54133 1 0 0 0 0 56 57 1 0 0 0 0 56134 1 0 0 0 0 56135 1 0 0 0 0 57136 1 0 0 0 0 57137 1 0 0 0 0 57138 1 0 0 0 0 58 62 1 0 0 0 0 59 60 1 0 0 0 0 59 64 1 0 0 0 0 59 65 1 0 0 0 0 59139 1 0 0 0 0 60 61 1 0 0 0 0 60 66 1 0 0 0 0 60140 1 0 0 0 0 61 62 1 0 0 0 0 61 67 1 0 0 0 0 61141 1 0 0 0 0 62 63 1 0 0 0 0 62142 1 0 0 0 0 63 64 1 0 0 0 0 64143 1 0 0 0 0 64144 1 0 0 0 0 65145 1 0 0 0 0 66146 1 0 0 0 0 67147 1 0 0 0 0 M END > 43 $$$$ 44 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 130135 0 0 1 0 0 0 0 0999 V2000 -0.1270 3.1100 -2.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0940 1.5940 -2.5110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2680 1.2530 -1.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4330 1.9570 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.3800 -1.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1690 3.8070 -2.9290 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3900 1.1620 -3.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 3.4450 -3.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 4.0240 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 5.2230 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.6370 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.2600 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 1.4260 3.1160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1260 1.8340 4.5140 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8300 1.0860 4.8400 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2120 1.3920 3.7610 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3050 1.0170 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 1.7190 2.1030 C 0 0 2 0 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16 1 0 0 0 0 15 58 1 0 0 0 0 15 75 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 76 1 0 0 0 0 17 18 1 0 0 0 0 18 77 1 0 0 0 0 19 78 1 0 0 0 0 20 79 1 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 80 1 0 0 0 0 22 81 1 0 0 0 0 23 24 1 0 0 0 0 23 82 1 0 0 0 0 24 27 1 0 0 0 0 24 83 1 0 0 0 0 24 84 1 0 0 0 0 25 26 1 0 0 0 0 25 85 1 0 0 0 0 25 86 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 87 1 0 0 0 0 28 88 1 0 0 0 0 29 31 1 0 0 0 0 29 89 1 0 0 0 0 29 90 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 91 1 0 0 0 0 31 35 1 0 0 0 0 31 92 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 93 1 0 0 0 0 32 94 1 0 0 0 0 33 95 1 0 0 0 0 33 96 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35 97 1 0 0 0 0 36 37 1 0 0 0 0 36 98 1 0 0 0 0 36 99 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 37100 1 0 0 0 0 38 41 1 0 0 0 0 38 59 1 0 0 0 0 39101 1 0 0 0 0 39102 1 0 0 0 0 39103 1 0 0 0 0 40104 1 0 0 0 0 40105 1 0 0 0 0 40106 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41107 1 0 0 0 0 42 44 1 0 0 0 0 42 51 2 0 0 0 0 43108 1 0 0 0 0 43109 1 0 0 0 0 43110 1 0 0 0 0 44 45 1 0 0 0 0 44111 1 0 0 0 0 44112 1 0 0 0 0 45 46 1 0 0 0 0 45113 1 0 0 0 0 45114 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46115 1 0 0 0 0 47 49 1 0 0 0 0 47116 1 0 0 0 0 47117 1 0 0 0 0 48118 1 0 0 0 0 48119 1 0 0 0 0 48120 1 0 0 0 0 49 52 1 0 0 0 0 49121 1 0 0 0 0 50122 1 0 0 0 0 52 53 2 0 0 0 0 52 54 1 0 0 0 0 54 56 1 0 0 0 0 54123 1 0 0 0 0 54124 1 0 0 0 0 56 57 1 0 0 0 0 56125 1 0 0 0 0 56126 1 0 0 0 0 57127 1 0 0 0 0 57128 1 0 0 0 0 57129 1 0 0 0 0 58130 1 0 0 0 0 M END > 44 $$$$ 45 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 156165 0 0 1 0 0 0 0 0999 V2000 -1.8270 2.6590 0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4440 1.2290 -0.3930 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5470 0.6310 0.6940 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6070 1.4570 0.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 2.7920 1.2790 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5500 3.4770 0.2160 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7400 1.2490 -1.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 3.2510 -1.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 3.5710 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 4.7930 0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 0.5630 1.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -11.1980 9.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -12.4170 10.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -13.5890 9.7920 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3480 -13.0930 8.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 -11.7200 8.6500 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9240 -3.5580 1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -2.3310 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -0.2400 2.9250 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7430 0.4610 4.2830 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1350 -0.4430 5.3590 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8560 -1.7940 5.3470 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7490 -2.3780 4.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -1.5980 3.0070 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0280 1.6970 4.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -2.6630 6.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 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02.08.2006 137144 0 0 1 0 0 0 0 0999 V2000 0.4560 3.4130 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.8790 0.3380 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7190 1.4510 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 2.3310 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 3.6290 0.0500 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7440 1.5300 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 -3.0490 -17.6310 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2500 -1.5610 -17.3990 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0210 -0.9140 -16.7540 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8840 -1.1100 -17.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 -2.4820 -17.8120 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7160 -3.1920 -18.4980 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5240 -0.9260 -18.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0840 -3.6460 -18.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 -2.5690 -18.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 -4.5770 -18.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -1.5140 -15.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2570 1.7600 -13.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4860 1.0550 -14.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 -0.7980 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35103 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 36104 1 0 0 0 0 37 43 1 0 0 0 0 37105 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38106 1 0 0 0 0 38107 1 0 0 0 0 39108 1 0 0 0 0 39109 1 0 0 0 0 40110 1 0 0 0 0 40111 1 0 0 0 0 40112 1 0 0 0 0 41 42 1 0 0 0 0 41113 1 0 0 0 0 41114 1 0 0 0 0 41115 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 43 44 1 0 0 0 0 43116 1 0 0 0 0 44 46 1 0 0 0 0 44117 1 0 0 0 0 44118 1 0 0 0 0 45 46 1 0 0 0 0 45 48 1 0 0 0 0 45119 1 0 0 0 0 46 47 1 0 0 0 0 46120 1 0 0 0 0 47 51 1 0 0 0 0 48 49 1 0 0 0 0 48 50 2 0 0 0 0 49121 1 0 0 0 0 49122 1 0 0 0 0 49123 1 0 0 0 0 51 52 2 0 0 0 0 53 54 1 0 0 0 0 54124 1 0 0 0 0 54125 1 0 0 0 0 54126 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 56 61 1 0 0 0 0 56 63 1 0 0 0 0 56127 1 0 0 0 0 57 58 1 0 0 0 0 57 62 1 0 0 0 0 57128 1 0 0 0 0 58 59 1 0 0 0 0 58129 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 60 64 1 0 0 0 0 60130 1 0 0 0 0 61 65 1 0 0 0 0 61131 1 0 0 0 0 62132 1 0 0 0 0 63133 1 0 0 0 0 64134 1 0 0 0 0 64135 1 0 0 0 0 64136 1 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evaluation license 3.40 0067 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4350 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 5.9860 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 6.0040 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 5.1240 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 5.0780 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 4.1800 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 4.2020 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 3.2380 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 2.4770 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 2.1100 0.0200 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2100 3.3020 0.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0530 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.6730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.1500 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -2.7230 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -1.8710 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -0.6260 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 6.8670 2.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 3.0600 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -1.6070 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -2.6130 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 2.0000 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 6.7160 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 5.1390 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 5.0720 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 1.5710 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 3.1060 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 1.4710 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -2.7460 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -3.7990 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 6.5430 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.5550 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -0.9900 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -1.0870 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -2.8120 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -2.0000 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -3.5560 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 13 1 0 0 0 0 2 16 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 10 2 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 2 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 21 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END > 50 $$$$ 51 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 0.0340 1.3000 0.0510 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0880 -0.1270 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 4.2000 4.0720 5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.6440 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -2.8200 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -0.5080 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.8660 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 1.4470 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -2.5970 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 3.4340 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 1.2900 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 0.3890 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 2.9900 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -4.7830 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 5.3390 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 5.2210 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 3.6160 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 5.0700 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 6.1240 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 6.3270 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 3.3820 5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 4.8930 5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 3.5450 5.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 1 25 1 0 0 0 0 2 4 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 3 8 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END > 51 $$$$ 52 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.6460 0.2600 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -1.1070 -3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -1.6100 -2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 1.1250 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 0.6330 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.7480 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -1.2360 -1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -0.3650 -1.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8610 0.9080 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 1.5460 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.0600 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -0.8300 -1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7260 -1.4620 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -2.3280 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -2.5570 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -1.9230 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 -3.4980 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -2.7520 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -2.6950 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -3.2340 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -2.0910 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 2.7480 -1.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -1.9550 -3.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 -2.9510 0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1110 -1.2110 -1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -2.2840 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8430 -1.9560 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 -0.5130 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0020 -3.0200 -5.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 0.6400 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.6720 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 2.1850 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -0.1000 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 0.6520 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 1.5950 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -0.1560 -2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -2.1010 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -3.8970 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 -4.3170 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -2.2660 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -4.2920 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -2.6900 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -3.1080 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 -1.0530 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -2.1320 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 -2.6520 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -2.1110 -4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -2.4570 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 -0.2370 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8290 -1.2260 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4040 -3.3250 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 0.0910 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1210 -0.4240 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3870 -0.1630 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 -3.1520 -5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -2.7180 -5.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -3.9600 -4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 3 6 2 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END > 52 $$$$ 53 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.1950 2.4220 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 1.1900 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 1.7070 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 2.6800 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 8.2020 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 8.1530 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 6.9640 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 7.0670 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 5.8690 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 5.8130 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 4.5360 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 3.4290 -2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 3.4830 -0.7350 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7070 4.7680 -0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 0.4710 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 0.2140 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 9.3730 0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 4.3730 -3.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 6.9120 -3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -0.4880 0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 1.9890 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -1.1280 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -1.1300 2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -1.2460 3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -1.1490 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.4760 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 1.4870 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 2.3160 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 3.7930 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 1.7930 -4.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.9910 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 3.6430 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 9.0430 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 7.1210 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.4620 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 3.5890 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 3.3080 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 9.5090 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 7.1020 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -0.4650 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 3.0630 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 1.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -1.3190 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -1.9060 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.0360 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.9350 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -2.0940 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.3480 2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.5160 5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.0520 4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.0270 4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 0.4440 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 4.0160 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 4.3500 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 4.0810 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 0.7100 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.2440 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 2.0470 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 13 1 0 0 0 0 2 16 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 3 21 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 10 2 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 22 1 0 0 0 0 17 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 27 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END > 53 $$$$ 54 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 2.1110 0.5520 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -0.7560 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.4060 -1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 1.6340 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 6.2610 -6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 5.1930 -7.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 3.8960 -7.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 6.0350 -5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 4.7500 -5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 3.6660 -6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 2.2880 -5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 2.0520 -4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.7880 -4.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 0.1050 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -0.9730 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 7.5320 -7.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 1.3450 -6.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 2.8490 -7.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -0.1130 -0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 2.5700 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.3800 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -2.8360 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -3.8840 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -4.5300 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -4.4460 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 2.9100 -1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 4.1420 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 5.2580 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 4.4430 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -1.5940 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 2.6450 -3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 5.3730 -8.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 6.8720 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 4.5790 -4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.8880 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.0470 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 7.8820 -6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 2.5670 -8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 -0.1960 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 3.4320 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 2.3030 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -3.0420 -2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 -2.4060 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -2.2980 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -5.2240 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -5.0710 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -3.7600 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -3.9660 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -5.5200 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -4.2570 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 2.1380 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 4.8590 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 6.0120 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 5.7110 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 4.3760 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 5.4480 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 3.7210 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 13 1 0 0 0 0 2 15 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 14 2 0 0 0 0 3 20 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 10 2 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 21 1 0 0 0 0 16 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 26 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END > 54 $$$$ 55 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 1.4960 2.1200 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 0.9750 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 0.8960 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 2.0800 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 8.1130 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 8.3760 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 7.3410 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 6.8160 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 5.7660 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 6.0270 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 4.9080 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 3.5800 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 3.4110 0.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5170 4.5050 1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.2540 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -0.2120 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 9.1350 2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 5.0380 -2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 7.5930 -1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -1.4200 1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 0.8540 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.4600 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -1.5910 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -1.6470 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -1.4640 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -1.8930 5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 0.4000 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 1.1570 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 2.5020 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 0.6820 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -1.6470 3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.0080 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 2.9760 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 9.3890 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 6.6260 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 2.7680 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 3.5870 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 3.3930 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 9.3240 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 7.7760 -2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 1.8480 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 0.1560 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.3970 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -2.3300 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -1.6400 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -2.4170 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -1.1130 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -0.7320 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -0.9390 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -2.4180 5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -2.4990 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 -0.5480 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6200 2.3760 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 3.1460 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 2.9570 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 0.5090 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 1.4400 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 -0.2460 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -1.5450 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -2.6520 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -0.9160 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 13 1 0 0 0 0 2 16 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 3 21 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 10 2 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 22 1 0 0 0 0 17 39 1 0 0 0 0 19 40 1 0 0 0 0 20 31 1 0 0 0 0 21 27 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 M END > 55 $$$$ 56 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.0060 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0850 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 1.3930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 2.0820 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 3.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 4.1860 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 3.5570 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 4.2090 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 4.0990 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 3.3430 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 3.9770 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 5.3650 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 6.1200 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 5.4950 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 5.9860 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 2.0460 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.0440 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 7.4140 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.5340 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 5.2640 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 2.2640 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 3.3940 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 7.1980 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 6.0820 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 2.2350 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -2.4330 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 7.7810 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 7.7710 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6180 7.7810 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 21 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 M END > 56 $$$$ 57 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7850 -0.4890 -1.2210 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1060 0.0540 -1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 1.4820 -1.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4220 2.0470 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8570 -1.9160 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.9480 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 1.6260 1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 1.5180 -2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.9900 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.5000 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.7390 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -2.5160 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -3.8980 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.3390 -4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -3.7350 -4.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -4.5190 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -5.8640 -3.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -6.4960 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -5.8290 -5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -4.4160 -5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -7.9690 -4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -8.6820 -3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -10.0570 -3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -10.7360 -4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -10.0310 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -8.6560 -5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -3.7860 -6.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -1.5820 -5.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -12.0920 -4.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -12.7270 -5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.3670 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.1600 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 1.8370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 3.1360 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.0360 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 1.5200 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 1.9440 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.7790 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 1.6930 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -1.4640 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -0.6630 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -4.4920 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -6.3750 -6.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -8.1550 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -10.6090 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -10.5630 -6.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -8.1080 -6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -1.3190 -5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -13.8080 -5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -12.4700 -6.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -12.3860 -5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 36 1 0 0 0 0 6 9 1 0 0 0 0 6 37 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 18 2 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 29 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END > 57 $$$$ 58 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 73 77 0 0 1 0 0 0 0 0999 V2000 0.0650 -1.3840 -0.6140 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1100 -2.1240 0.7160 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4580 -1.2620 1.8470 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9260 -0.9450 1.5480 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0210 -0.2850 0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -1.0620 -0.8180 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3660 -1.9730 3.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.3640 0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -0.2820 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.8740 -2.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -0.8730 -3.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.2100 -1.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -0.0930 2.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 4.1240 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 5.4530 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 6.4100 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 6.0220 1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 4.6850 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 3.7420 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 6.9530 1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 8.2560 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 8.7330 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -0.6720 3.4620 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5370 -0.9160 3.4700 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8650 0.0770 2.5170 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2250 1.5030 2.9420 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6460 1.6540 2.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 0.7830 3.8510 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6480 2.4340 2.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 5.8270 5.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 7.8370 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 8.2300 4.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -1.5450 4.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -2.2510 3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 1.0480 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 0.4140 4.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 1.8310 2.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 9.2060 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 8.7460 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 9.6360 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 10.9900 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 11.4520 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 10.5680 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 11.8640 -2.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 13.2420 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -0.4580 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -3.0740 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.3330 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.8710 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -1.9910 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -1.4850 3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -2.9000 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -0.3320 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.8040 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 3.3800 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 4.3770 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 9.7890 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 -0.8630 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -0.7730 4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -0.0990 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 1.6920 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 0.9630 4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 6.0510 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 -1.4440 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -2.9340 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 0.6160 4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 7.6940 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 9.2820 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 12.5050 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 10.9270 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 13.5900 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 13.8300 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 13.3550 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 6 9 1 0 0 0 0 6 50 1 0 0 0 0 7 51 1 0 0 0 0 8 52 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 53 1 0 0 0 0 12 54 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 55 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 31 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 33 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 28 35 1 0 0 0 0 28 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 66 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 67 1 0 0 0 0 40 41 1 0 0 0 0 40 68 1 0 0 0 0 41 42 2 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 42 69 1 0 0 0 0 43 70 1 0 0 0 0 44 45 1 0 0 0 0 45 71 1 0 0 0 0 45 72 1 0 0 0 0 45 73 1 0 0 0 0 M END > 58 $$$$ 59 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 88 0 0 1 0 0 0 0 0999 V2000 0.7290 1.2600 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.0350 0.4960 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3630 -1.2320 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 1.0520 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -0.1410 2.1940 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8400 -1.3760 1.6110 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1600 -2.5920 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -2.8670 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -0.3740 2.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4760 -1.6810 2.8450 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2360 0.5340 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 0.7950 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -0.6510 2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -1.8970 2.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5360 -2.9870 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 -3.3070 3.0960 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2780 -0.7380 2.8920 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8810 -2.1170 2.9570 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7070 -2.3020 1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9250 -1.4120 2.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4800 0.0530 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9560 0.1520 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 0.2320 0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -1.2670 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.4220 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 0.2190 3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -1.6210 4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -2.2960 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 -4.1330 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1300 0.9230 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9860 0.5640 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1260 -1.6900 3.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 -2.1470 3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8950 -2.5470 5.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 -0.1120 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 2.1290 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 1.4710 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.0990 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 0.8440 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 1.9460 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -1.5620 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -2.4280 3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -3.4710 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.7610 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -3.0540 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -0.3870 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 1.3990 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 1.7040 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 0.9660 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -2.6640 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -3.8950 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -3.9080 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0210 -3.3410 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 -1.9380 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8100 -1.6410 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5790 -0.1020 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6670 1.1980 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 1.0000 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -1.3690 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -2.1150 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -0.3430 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -2.4110 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -3.3580 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -2.3330 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 0.6150 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -0.6720 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.9720 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -2.4890 4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 -0.7100 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -1.6200 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -1.5010 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1940 -2.4540 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -3.2160 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5880 -4.9850 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2080 0.9500 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7290 1.9350 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9180 0.5060 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5520 -0.0420 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6880 1.6040 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0720 0.4890 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -0.6290 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 -0.2060 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 0.9420 4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 46 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 M END > 59 $$$$ 60 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 107112 0 0 1 0 0 0 0 0999 V2000 3.1450 2.5130 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 1.2210 -3.9920 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8740 0.7040 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 2.2770 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 1.8800 -1.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0240 0.6270 -1.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5900 0.1850 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -0.2840 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 1.5430 -0.7100 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8520 0.8620 0.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1780 2.4390 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 2.7980 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 1.3750 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 0.3470 1.2100 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9890 -0.1350 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 -0.4080 3.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5530 1.2210 1.8840 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2240 0.8100 3.3150 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5050 0.5840 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4630 -0.3790 3.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7900 0.0840 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 0.2390 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 1.4580 -4.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 1.5340 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.7320 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 3.0660 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 1.8810 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -0.8580 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 -1.5700 2.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5630 1.4000 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6570 -0.9890 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 -0.4430 4.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7740 -1.3770 5.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9920 -1.4990 5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0630 -2.4210 6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2560 -2.4620 7.8570 C 0 0 3 0 0 0 0 0 0 0 0 0 13.8390 -2.3750 9.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9040 -2.9400 10.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6480 -3.9260 9.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9540 -3.8430 7.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6660 -4.6820 9.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2210 -4.6270 10.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 1.9720 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 2.9790 3.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 1.8800 5.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8320 -2.1180 5.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1600 -0.5800 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0350 2.2170 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 2.8180 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 3.3100 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 0.4590 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 1.4730 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 3.1900 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -0.1780 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 0.9810 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -0.6670 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -0.6350 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -1.1190 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 0.8580 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 3.1010 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 3.1830 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 3.5840 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 0.5400 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -1.0910 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -0.6130 4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 1.5460 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2340 0.1770 5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0340 -1.3810 3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 -0.7420 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 0.6100 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 1.7610 -5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 1.3660 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 1.2370 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 2.5900 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -1.3500 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -1.1550 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.7030 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 3.4520 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 2.7460 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 3.8490 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 1.3950 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 2.7050 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 2.2650 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -0.5380 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5370 -1.2680 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -1.6220 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -2.3760 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4940 1.2620 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7870 1.7130 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 2.1640 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1100 -1.9310 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8990 -0.6730 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5780 -1.1240 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2650 -3.1400 7.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9550 -1.6610 7.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5810 -2.1520 10.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4910 -3.4570 10.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2210 -4.6430 7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6810 -3.8700 6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1060 -5.3450 8.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0580 -5.3210 10.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5640 -3.6150 11.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4440 -4.9060 11.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 2.6450 5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1020 0.2730 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0900 -1.1200 5.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1310 -0.2270 4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 51 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 8 10 1 0 0 0 0 8 57 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 59 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 60 1 0 0 0 0 12 61 1 0 0 0 0 12 62 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 63 1 0 0 0 0 15 64 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 66 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 68 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 69 1 0 0 0 0 22 70 1 0 0 0 0 23 71 1 0 0 0 0 24 72 1 0 0 0 0 24 73 1 0 0 0 0 24 74 1 0 0 0 0 25 75 1 0 0 0 0 25 76 1 0 0 0 0 25 77 1 0 0 0 0 26 78 1 0 0 0 0 26 79 1 0 0 0 0 26 80 1 0 0 0 0 27 81 1 0 0 0 0 27 82 1 0 0 0 0 27 83 1 0 0 0 0 28 84 1 0 0 0 0 28 85 1 0 0 0 0 28 86 1 0 0 0 0 29 87 1 0 0 0 0 30 88 1 0 0 0 0 30 89 1 0 0 0 0 30 90 1 0 0 0 0 31 91 1 0 0 0 0 31 92 1 0 0 0 0 31 93 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 46 2 0 0 0 0 34 35 2 0 0 0 0 34 47 1 0 0 0 0 35 36 1 0 0 0 0 35 94 1 0 0 0 0 36 37 1 0 0 0 0 36 40 1 0 0 0 0 36 95 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 96 1 0 0 0 0 38 97 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 98 1 0 0 0 0 40 99 1 0 0 0 0 41 42 1 0 0 0 0 41100 1 0 0 0 0 42101 1 0 0 0 0 42102 1 0 0 0 0 42103 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45104 1 0 0 0 0 47105 1 0 0 0 0 47106 1 0 0 0 0 47107 1 0 0 0 0 M END > 60 $$$$ 61 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 78 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8090 -0.4990 1.2060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2160 0.1010 1.1490 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1240 1.5270 1.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 2.0500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4090 3.5780 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.0020 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.5010 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -1.9250 1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 4.0700 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 6.0400 -2.5140 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9540 5.4390 -1.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3220 5.9030 -0.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8460 5.4950 -0.0070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1810 6.0620 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 5.6270 -2.3970 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8970 6.2720 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 5.5560 -3.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 5.8790 -1.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 7.3240 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -0.3120 2.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 0.0500 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -0.3210 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 1.1520 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 0.7840 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 0.7810 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 0.0390 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 -0.3130 4.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 0.0200 4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0740 0.7360 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3580 1.1540 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.8680 0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8990 1.7970 1.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 -0.4060 5.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 -1.1430 6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2860 -1.5400 7.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6310 -1.2080 8.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2590 -0.4750 7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5520 -0.0800 5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3320 -1.6000 9.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7100 -1.2250 9.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8800 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.3570 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -0.1880 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -0.2440 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 1.7310 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 3.9740 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 3.8960 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 1.7050 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.4660 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -2.3080 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 7.1270 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 4.3510 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 5.4360 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 5.8600 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 4.5420 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 5.9420 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 5.9780 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 7.3570 -3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 5.8970 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 5.5360 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 7.6870 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -0.8920 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 1.0670 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1190 0.9850 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 1.3260 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -1.4010 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8020 -2.1090 8.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3040 -0.2190 7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0410 0.4900 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2380 -1.6500 8.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7920 -0.1380 9.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1520 -1.6000 10.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 7 11 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 50 1 0 0 0 0 9 51 1 0 0 0 0 10 52 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 19 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 19 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 26 2 0 0 0 0 24 28 2 0 0 0 0 24 64 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 25 33 1 0 0 0 0 26 65 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 32 34 2 0 0 0 0 33 67 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 69 1 0 0 0 0 38 39 2 0 0 0 0 38 41 1 0 0 0 0 39 40 1 0 0 0 0 39 70 1 0 0 0 0 40 71 1 0 0 0 0 41 42 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 M END > 61 $$$$ 62 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 22 23 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4630 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 2.2200 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.5710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 0.1040 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6680 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -2.0450 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -2.1570 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.9330 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -0.4760 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 2.0580 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 3.5730 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -3.4530 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 4.2420 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 2.1330 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -2.8560 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -3.7720 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -3.3090 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -4.2160 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 3.9540 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 3.9640 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 5.3210 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 2 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 12 14 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 M END > 62 $$$$ 63 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 100104 0 0 1 0 0 0 0 0999 V2000 -0.1500 1.7410 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.3470 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -0.3540 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.3270 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 1.7160 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 2.4220 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -0.3650 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 2.3780 0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -1.7100 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -2.3440 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 3.8020 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 2.4920 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 1.8980 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 3.8350 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 5.9020 0.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6780 4.5080 -0.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0740 4.6470 -1.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1100 5.4560 -2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 6.7860 -1.7750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5640 6.7330 -0.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1190 3.3530 -2.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 6.5400 0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 8.0590 0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 7.5640 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 7.7130 -3.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 2.5890 -5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 3.9690 -5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 4.6010 -5.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0640 3.8460 -5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9860 2.4590 -5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 1.8340 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 3.9130 -8.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 3.6630 -8.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 3.0150 -7.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 3.5150 -7.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 2.8690 -6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 2.6150 -6.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 1.9050 -5.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5950 1.9290 -4.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1540 1.4260 -4.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3510 2.4790 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2750 4.4640 -5.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1200 1.7160 -5.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 5.9590 -5.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 6.6710 -5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 2.7700 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14 1 0 0 0 0 14 16 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 22 1 0 0 0 0 15 64 1 0 0 0 0 16 17 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 66 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 67 1 0 0 0 0 20 23 1 0 0 0 0 20 68 1 0 0 0 0 21 54 1 0 0 0 0 22 69 1 0 0 0 0 23 70 1 0 0 0 0 24 25 1 0 0 0 0 24 71 1 0 0 0 0 24 72 1 0 0 0 0 25 73 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 26 38 1 0 0 0 0 27 28 2 0 0 0 0 27 74 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 42 1 0 0 0 0 30 31 1 0 0 0 0 30 43 1 0 0 0 0 31 75 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 32 49 1 0 0 0 0 33 34 1 0 0 0 0 33 48 1 0 0 0 0 34 37 2 0 0 0 0 34 46 1 0 0 0 0 35 36 2 0 0 0 0 35 76 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 77 1 0 0 0 0 39 40 1 0 0 0 0 39 54 1 0 0 0 0 39 78 1 0 0 0 0 40 41 1 0 0 0 0 40 50 1 0 0 0 0 40 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 42 82 1 0 0 0 0 43 53 1 0 0 0 0 44 45 1 0 0 0 0 45 83 1 0 0 0 0 45 84 1 0 0 0 0 45 85 1 0 0 0 0 46 47 1 0 0 0 0 47 86 1 0 0 0 0 47 87 1 0 0 0 0 47 88 1 0 0 0 0 48 89 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 50 90 1 0 0 0 0 50 91 1 0 0 0 0 51 92 1 0 0 0 0 52 93 1 0 0 0 0 52 94 1 0 0 0 0 52 95 1 0 0 0 0 53 96 1 0 0 0 0 53 97 1 0 0 0 0 53 98 1 0 0 0 0 54 99 1 0 0 0 0 54100 1 0 0 0 0 M END > 63 $$$$ 64 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 138145 0 0 1 0 0 0 0 0999 V2000 10.2920 -1.1180 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 -2.5000 -1.7210 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9100 -3.2140 -0.8790 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7900 -1.2520 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6780 -1.8520 1.1660 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2820 -3.2080 0.5870 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2150 -3.8460 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8850 -4.1800 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2640 -2.0770 2.5630 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4050 -2.9180 3.4980 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1320 -0.9790 4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5840 -0.7370 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9640 -2.0840 5.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2280 -3.2760 4.7460 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3580 -3.9430 5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0690 -4.0410 7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5490 -2.1050 6.6840 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4930 -2.6610 7.6360 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0150 -2.7060 9.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2740 -3.5670 9.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2800 -3.0320 8.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8190 -2.9530 6.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4940 -2.3590 -3.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -4.6660 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -2.6320 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1520 -5.5620 -0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 -4.9440 -2.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 -0.8660 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 -2.0980 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2840 -4.3040 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -1.7350 7.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -0.7370 6.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4770 -2.6610 8.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7940 -1.0730 6.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 -3.8570 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2320 -2.5990 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2200 -2.0200 8.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -0.6180 9.0970 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9340 -1.6360 9.1160 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1110 -1.0850 8.3070 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5160 0.1710 8.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 1.1770 8.8190 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3000 0.7170 9.6480 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0550 2.4800 9.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1020 2.9700 8.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.0910 9.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 1.6950 9.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 -2.8650 8.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4620 5.8920 8.5760 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8740 4.5530 8.1180 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6900 4.1900 9.0170 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7170 5.2350 8.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 6.5000 9.4290 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3610 6.9560 8.5460 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0670 7.5300 9.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 7.1640 10.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5210 6.2750 7.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 8.1930 9.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8740 3.5360 8.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4800 10.6090 9.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9500 10.6090 8.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4760 9.3360 8.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0560 9.2730 6.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4840 9.2230 6.9780 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0380 10.4910 7.6320 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9890 9.1290 5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4650 10.4170 7.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9340 11.8280 9.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5020 11.7540 8.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0950 -0.6660 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4260 -0.4660 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8850 -3.1040 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6560 -1.9160 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 -0.2740 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 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10.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -3.5570 8.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8460 5.7930 9.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 4.6390 7.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 4.0650 10.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5370 6.4050 10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0110 7.0900 7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4550 8.5130 9.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6670 7.5610 8.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 7.7740 10.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2230 5.6150 7.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5710 2.6600 7.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8210 9.7630 9.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5440 10.6370 10.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 9.3510 8.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8180 8.3490 7.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7390 11.3620 7.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7360 10.0450 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0710 8.9970 5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5210 8.2780 5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8860 10.3410 6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6120 11.9710 10.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 11.8180 8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 70 1 0 0 0 0 1 71 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 72 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 73 1 0 0 0 0 4 74 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 75 1 0 0 0 0 7 76 1 0 0 0 0 8 10 1 0 0 0 0 8 77 1 0 0 0 0 8 78 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 79 1 0 0 0 0 12 80 1 0 0 0 0 12 81 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 82 1 0 0 0 0 15 83 1 0 0 0 0 16 18 1 0 0 0 0 16 84 1 0 0 0 0 16 85 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 86 1 0 0 0 0 19 87 1 0 0 0 0 20 21 1 0 0 0 0 20 88 1 0 0 0 0 20 89 1 0 0 0 0 21 22 1 0 0 0 0 21 33 2 0 0 0 0 22 90 1 0 0 0 0 22 91 1 0 0 0 0 23 92 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 93 1 0 0 0 0 25 94 1 0 0 0 0 25 95 1 0 0 0 0 27 96 1 0 0 0 0 28 97 1 0 0 0 0 28 98 1 0 0 0 0 28 99 1 0 0 0 0 29100 1 0 0 0 0 29101 1 0 0 0 0 29102 1 0 0 0 0 30103 1 0 0 0 0 30104 1 0 0 0 0 30105 1 0 0 0 0 31 32 2 0 0 0 0 31 37 1 0 0 0 0 33106 1 0 0 0 0 33107 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 43 1 0 0 0 0 38 46 1 0 0 0 0 38108 1 0 0 0 0 39 40 1 0 0 0 0 39 48 1 0 0 0 0 39109 1 0 0 0 0 40 41 1 0 0 0 0 40110 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42111 1 0 0 0 0 43 47 1 0 0 0 0 43112 1 0 0 0 0 44 45 1 0 0 0 0 44113 1 0 0 0 0 44114 1 0 0 0 0 45 51 1 0 0 0 0 46115 1 0 0 0 0 47116 1 0 0 0 0 48117 1 0 0 0 0 49 50 1 0 0 0 0 49 54 1 0 0 0 0 49 57 1 0 0 0 0 49118 1 0 0 0 0 50 51 1 0 0 0 0 50 59 1 0 0 0 0 50119 1 0 0 0 0 51 52 1 0 0 0 0 51120 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53121 1 0 0 0 0 54 58 1 0 0 0 0 54122 1 0 0 0 0 55 56 1 0 0 0 0 55123 1 0 0 0 0 55124 1 0 0 0 0 56125 1 0 0 0 0 57126 1 0 0 0 0 58 62 1 0 0 0 0 59127 1 0 0 0 0 60 61 1 0 0 0 0 60 65 1 0 0 0 0 60 68 1 0 0 0 0 60128 1 0 0 0 0 61 62 1 0 0 0 0 61 69 1 0 0 0 0 61129 1 0 0 0 0 62 63 1 0 0 0 0 62130 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 64131 1 0 0 0 0 65 67 1 0 0 0 0 65132 1 0 0 0 0 66133 1 0 0 0 0 66134 1 0 0 0 0 66135 1 0 0 0 0 67136 1 0 0 0 0 68137 1 0 0 0 0 69138 1 0 0 0 0 M END > 64 $$$$ 65 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 137144 0 0 1 0 0 0 0 0999 V2000 10.0950 -1.3000 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 -2.6870 -1.6620 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6730 -3.3720 -0.8470 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5410 -1.4200 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3910 -1.9900 1.2030 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9940 -3.3490 0.6310 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8880 -3.9580 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -4.2810 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9250 -2.2030 2.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0220 -3.0160 3.5400 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7390 -1.0860 4.6760 C 0 0 0 0 0 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0 0 0 0 51122 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53123 1 0 0 0 0 54 58 1 0 0 0 0 54124 1 0 0 0 0 55 56 1 0 0 0 0 55125 1 0 0 0 0 55126 1 0 0 0 0 56127 1 0 0 0 0 57128 1 0 0 0 0 58 62 1 0 0 0 0 59129 1 0 0 0 0 60 61 1 0 0 0 0 60 65 1 0 0 0 0 60 68 1 0 0 0 0 60130 1 0 0 0 0 61 62 1 0 0 0 0 61 69 1 0 0 0 0 61131 1 0 0 0 0 62 63 1 0 0 0 0 62132 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 64133 1 0 0 0 0 65 67 1 0 0 0 0 65134 1 0 0 0 0 66135 1 0 0 0 0 66136 1 0 0 0 0 66137 1 0 0 0 0 67138 1 0 0 0 0 68139 1 0 0 0 0 69140 1 0 0 0 0 M END > 66 $$$$ 67 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 144151 0 0 1 0 0 0 0 0999 V2000 2.8890 1.3050 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -0.2120 -0.5990 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7090 -0.7940 0.6340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2790 1.9250 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 1.4360 0.9220 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0210 -0.0870 0.8950 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7300 -0.5860 2.1520 C 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 0 14.8090 4.1330 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 15.7800 4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 15.6930 6.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 13.5600 6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 13.9200 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 16.3190 3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 15.7320 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 17.8610 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 14.4670 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 14.4830 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 12.9660 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 16.2630 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 11.7020 7.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 13.2580 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 12.2420 9.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 11.6420 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 11.8270 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 9.4720 4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 9.9700 5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 12.0410 6.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5710 11.3040 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0 0 0 0 39 40 1 0 0 0 0 39 47 1 0 0 0 0 39116 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 45 1 0 0 0 0 41117 1 0 0 0 0 42 46 1 0 0 0 0 42118 1 0 0 0 0 43119 1 0 0 0 0 44120 1 0 0 0 0 45121 1 0 0 0 0 45122 1 0 0 0 0 45123 1 0 0 0 0 46124 1 0 0 0 0 47 50 1 0 0 0 0 48 49 1 0 0 0 0 48 55 1 0 0 0 0 48125 1 0 0 0 0 48126 1 0 0 0 0 49127 1 0 0 0 0 50 51 1 0 0 0 0 50 55 1 0 0 0 0 50128 1 0 0 0 0 51 52 1 0 0 0 0 51 56 1 0 0 0 0 51129 1 0 0 0 0 52 53 1 0 0 0 0 52 57 1 0 0 0 0 52130 1 0 0 0 0 53 54 1 0 0 0 0 53 58 1 0 0 0 0 53131 1 0 0 0 0 54 55 1 0 0 0 0 55132 1 0 0 0 0 56133 1 0 0 0 0 57134 1 0 0 0 0 58 59 1 0 0 0 0 59 65 1 0 0 0 0 59135 1 0 0 0 0 59136 1 0 0 0 0 60 61 1 0 0 0 0 60 65 1 0 0 0 0 60 66 1 0 0 0 0 60137 1 0 0 0 0 61 62 1 0 0 0 0 61 67 1 0 0 0 0 61138 1 0 0 0 0 62 63 1 0 0 0 0 62 68 1 0 0 0 0 62139 1 0 0 0 0 63 64 1 0 0 0 0 63140 1 0 0 0 0 64 65 1 0 0 0 0 65141 1 0 0 0 0 66142 1 0 0 0 0 67143 1 0 0 0 0 68144 1 0 0 0 0 M END > 67 $$$$ 68 MOE2008 3D CORINA evaluation license 3.40 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0 0 12.3090 0.4290 1.7760 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8140 0.3860 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 0.3900 -1.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -0.7530 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -2.0860 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.3530 -1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 1.0690 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -0.4160 3.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 -1.2880 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 0.0150 5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7180 1.8240 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0960 0.0770 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6840 -0.7340 6.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 1.0000 5.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 12.0520 8.9700 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4360 11.4200 10.0150 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7680 10.1820 9.4130 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0520 10.5550 8.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8720 11.1070 7.2030 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5450 12.3830 7.7160 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4350 12.3650 10.3990 O 0 0 0 0 0 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1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 74 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 75 1 0 0 0 0 4 76 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 71 1 0 0 0 0 7 8 1 0 0 0 0 7 77 1 0 0 0 0 7 78 1 0 0 0 0 8 10 1 0 0 0 0 8 79 1 0 0 0 0 8 80 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 70 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 81 1 0 0 0 0 12 82 1 0 0 0 0 12 83 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 84 1 0 0 0 0 15 85 1 0 0 0 0 16 18 1 0 0 0 0 16 86 1 0 0 0 0 16 87 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 69 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 88 1 0 0 0 0 19 89 1 0 0 0 0 20 21 1 0 0 0 0 20 90 1 0 0 0 0 20 91 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 92 1 0 0 0 0 22 93 1 0 0 0 0 23 94 1 0 0 0 0 24 95 1 0 0 0 0 24 96 1 0 0 0 0 24 97 1 0 0 0 0 25 26 1 0 0 0 0 25 68 2 0 0 0 0 26 98 1 0 0 0 0 27 99 1 0 0 0 0 27100 1 0 0 0 0 27101 1 0 0 0 0 28102 1 0 0 0 0 28103 1 0 0 0 0 28104 1 0 0 0 0 29105 1 0 0 0 0 29106 1 0 0 0 0 29107 1 0 0 0 0 30 33 1 0 0 0 0 30 34 2 0 0 0 0 31 67 1 0 0 0 0 31108 1 0 0 0 0 31109 1 0 0 0 0 32110 1 0 0 0 0 32111 1 0 0 0 0 32112 1 0 0 0 0 33 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 1 0 0 0 0 35 42 1 0 0 0 0 35113 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 36114 1 0 0 0 0 37 38 1 0 0 0 0 37 45 1 0 0 0 0 37115 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 39116 1 0 0 0 0 40 44 1 0 0 0 0 40117 1 0 0 0 0 41118 1 0 0 0 0 42119 1 0 0 0 0 43120 1 0 0 0 0 43121 1 0 0 0 0 43122 1 0 0 0 0 44123 1 0 0 0 0 45 48 1 0 0 0 0 46 47 1 0 0 0 0 46 53 1 0 0 0 0 46124 1 0 0 0 0 46125 1 0 0 0 0 47126 1 0 0 0 0 48 49 1 0 0 0 0 48 53 1 0 0 0 0 48127 1 0 0 0 0 49 50 1 0 0 0 0 49 54 1 0 0 0 0 49128 1 0 0 0 0 50 51 1 0 0 0 0 50 55 1 0 0 0 0 50129 1 0 0 0 0 51 52 1 0 0 0 0 51 56 1 0 0 0 0 51130 1 0 0 0 0 52 53 1 0 0 0 0 53131 1 0 0 0 0 54132 1 0 0 0 0 55133 1 0 0 0 0 56 57 1 0 0 0 0 57 63 1 0 0 0 0 57134 1 0 0 0 0 57135 1 0 0 0 0 58 59 1 0 0 0 0 58 63 1 0 0 0 0 58 64 1 0 0 0 0 58136 1 0 0 0 0 59 60 1 0 0 0 0 59 65 1 0 0 0 0 59137 1 0 0 0 0 60 61 1 0 0 0 0 60 66 1 0 0 0 0 60138 1 0 0 0 0 61 62 1 0 0 0 0 61139 1 0 0 0 0 62 63 1 0 0 0 0 63140 1 0 0 0 0 64141 1 0 0 0 0 65142 1 0 0 0 0 66143 1 0 0 0 0 67144 1 0 0 0 0 M END > 68 $$$$ 69 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 144151 0 0 1 0 0 0 0 0999 V2000 2.6640 1.6930 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 0.3460 -0.9420 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4680 -0.7840 0.0700 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1410 1.6520 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 0.6030 1.1260 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8790 -0.7500 0.6150 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1340 -1.8140 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -1.9740 1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 0.5140 1.3860 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3030 -0.6650 2.2440 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8590 1.6870 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 1.8130 2.0070 C 0 0 0 0 0 0 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0 0 0 16 87 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 69 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 88 1 0 0 0 0 19 89 1 0 0 0 0 20 21 1 0 0 0 0 20 90 1 0 0 0 0 20 91 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 92 1 0 0 0 0 22 93 1 0 0 0 0 23 94 1 0 0 0 0 24 95 1 0 0 0 0 24 96 1 0 0 0 0 24 97 1 0 0 0 0 25 26 1 0 0 0 0 25 67 2 0 0 0 0 26 98 1 0 0 0 0 27 99 1 0 0 0 0 27100 1 0 0 0 0 27101 1 0 0 0 0 28102 1 0 0 0 0 28103 1 0 0 0 0 28104 1 0 0 0 0 29105 1 0 0 0 0 29106 1 0 0 0 0 29107 1 0 0 0 0 30 33 1 0 0 0 0 30 34 2 0 0 0 0 31108 1 0 0 0 0 31109 1 0 0 0 0 31110 1 0 0 0 0 32 68 1 0 0 0 0 32111 1 0 0 0 0 32112 1 0 0 0 0 33 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 1 0 0 0 0 35 42 1 0 0 0 0 35113 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 36114 1 0 0 0 0 37 38 1 0 0 0 0 37 45 1 0 0 0 0 37115 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 39116 1 0 0 0 0 40 44 1 0 0 0 0 40117 1 0 0 0 0 41118 1 0 0 0 0 42119 1 0 0 0 0 43120 1 0 0 0 0 43121 1 0 0 0 0 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0 0 7 77 1 0 0 0 0 8 10 1 0 0 0 0 8 78 1 0 0 0 0 8 79 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 69 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 80 1 0 0 0 0 12 81 1 0 0 0 0 12 82 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 83 1 0 0 0 0 15 84 1 0 0 0 0 16 18 1 0 0 0 0 16 85 1 0 0 0 0 16 86 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 68 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 87 1 0 0 0 0 19 88 1 0 0 0 0 20 21 1 0 0 0 0 20 89 1 0 0 0 0 20 90 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 91 1 0 0 0 0 22 92 1 0 0 0 0 23 93 1 0 0 0 0 24 94 1 0 0 0 0 24 95 1 0 0 0 0 24 96 1 0 0 0 0 25 26 1 0 0 0 0 25 67 2 0 0 0 0 26 97 1 0 0 0 0 27 98 1 0 0 0 0 27 99 1 0 0 0 0 27100 1 0 0 0 0 28101 1 0 0 0 0 28102 1 0 0 0 0 28103 1 0 0 0 0 29104 1 0 0 0 0 29105 1 0 0 0 0 29106 1 0 0 0 0 30 33 1 0 0 0 0 30 34 2 0 0 0 0 31107 1 0 0 0 0 31108 1 0 0 0 0 31109 1 0 0 0 0 32110 1 0 0 0 0 32111 1 0 0 0 0 32112 1 0 0 0 0 33 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 1 0 0 0 0 35 42 1 0 0 0 0 35113 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 36114 1 0 0 0 0 37 38 1 0 0 0 0 37 45 1 0 0 0 0 37115 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 39116 1 0 0 0 0 40 44 1 0 0 0 0 40117 1 0 0 0 0 41118 1 0 0 0 0 42119 1 0 0 0 0 43120 1 0 0 0 0 43121 1 0 0 0 0 43122 1 0 0 0 0 44123 1 0 0 0 0 45 48 1 0 0 0 0 46 47 1 0 0 0 0 46 53 1 0 0 0 0 46124 1 0 0 0 0 46125 1 0 0 0 0 47126 1 0 0 0 0 48 49 1 0 0 0 0 48 53 1 0 0 0 0 48127 1 0 0 0 0 49 50 1 0 0 0 0 49 54 1 0 0 0 0 49128 1 0 0 0 0 50 51 1 0 0 0 0 50 55 1 0 0 0 0 50129 1 0 0 0 0 51 52 1 0 0 0 0 51 56 1 0 0 0 0 51130 1 0 0 0 0 52 53 1 0 0 0 0 53131 1 0 0 0 0 54132 1 0 0 0 0 55133 1 0 0 0 0 56 57 1 0 0 0 0 57 63 1 0 0 0 0 57134 1 0 0 0 0 57135 1 0 0 0 0 58 59 1 0 0 0 0 58 63 1 0 0 0 0 58 64 1 0 0 0 0 58136 1 0 0 0 0 59 60 1 0 0 0 0 59 65 1 0 0 0 0 59137 1 0 0 0 0 60 61 1 0 0 0 0 60 66 1 0 0 0 0 60138 1 0 0 0 0 61 62 1 0 0 0 0 61139 1 0 0 0 0 62 63 1 0 0 0 0 63140 1 0 0 0 0 64141 1 0 0 0 0 65142 1 0 0 0 0 66143 1 0 0 0 0 M END > 70 $$$$ 71 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 143150 0 0 1 0 0 0 0 0999 V2000 2.6760 1.4990 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.1420 -0.7800 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4980 -0.9700 0.2410 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1660 1.4640 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 0.4340 1.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9280 -0.9280 0.7340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2220 -1.9730 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -2.1320 1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 0.3500 1.4110 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4090 -0.8160 2.2720 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9640 1.5370 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 1.6580 1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6020 0.4010 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 -0.9350 2.1660 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4780 -1.9520 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0040 -1.8940 3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0960 0.4990 2.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 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0 0 51 52 1 0 0 0 0 52130 1 0 0 0 0 53131 1 0 0 0 0 54132 1 0 0 0 0 55 56 1 0 0 0 0 56 62 1 0 0 0 0 56133 1 0 0 0 0 56134 1 0 0 0 0 57 58 1 0 0 0 0 57 62 1 0 0 0 0 57 63 1 0 0 0 0 57135 1 0 0 0 0 58 59 1 0 0 0 0 58 64 1 0 0 0 0 58136 1 0 0 0 0 59 60 1 0 0 0 0 59 65 1 0 0 0 0 59137 1 0 0 0 0 60 61 1 0 0 0 0 60138 1 0 0 0 0 61 62 1 0 0 0 0 62139 1 0 0 0 0 63140 1 0 0 0 0 64141 1 0 0 0 0 65142 1 0 0 0 0 67143 1 0 0 0 0 M END > 71 $$$$ 72 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 142149 0 0 1 0 0 0 0 0999 V2000 2.6890 1.5460 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 0.1770 -0.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5800 -0.9250 0.4770 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1930 1.5400 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 0.5210 1.3540 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0280 -0.8510 0.9100 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3870 -1.8860 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -2.0110 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 0.4700 1.5030 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5650 -0.6800 2.3520 C 0 0 2 0 0 0 0 0 0 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0 0 0 0 27105 1 0 0 0 0 27106 1 0 0 0 0 28 30 1 0 0 0 0 28107 1 0 0 0 0 28108 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 29 43 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 32 1 0 0 0 0 31109 1 0 0 0 0 31110 1 0 0 0 0 32 33 1 0 0 0 0 32111 1 0 0 0 0 32112 1 0 0 0 0 33 44 1 0 0 0 0 33113 1 0 0 0 0 34114 1 0 0 0 0 34115 1 0 0 0 0 34116 1 0 0 0 0 35117 1 0 0 0 0 35118 1 0 0 0 0 35119 1 0 0 0 0 37120 1 0 0 0 0 37121 1 0 0 0 0 37122 1 0 0 0 0 39123 1 0 0 0 0 40124 1 0 0 0 0 40125 1 0 0 0 0 40126 1 0 0 0 0 41127 1 0 0 0 0 41128 1 0 0 0 0 41129 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45130 1 0 0 0 0 45131 1 0 0 0 0 45132 1 0 0 0 0 46133 1 0 0 0 0 46134 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 49 74 1 0 0 0 0 50 51 1 0 0 0 0 50 55 1 0 0 0 0 50 59 1 0 0 0 0 50135 1 0 0 0 0 51 52 1 0 0 0 0 51 60 1 0 0 0 0 51136 1 0 0 0 0 52 53 1 0 0 0 0 52 56 1 0 0 0 0 52137 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54 57 1 0 0 0 0 54138 1 0 0 0 0 55 58 1 0 0 0 0 55139 1 0 0 0 0 56 66 1 0 0 0 0 57140 1 0 0 0 0 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0 0 2.8000 3.1100 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 1.9150 0.9090 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8610 0.8470 0.3170 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8410 -0.3910 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -1.0130 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 1.3260 0.9960 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2700 -0.0210 1.7080 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6230 1.7000 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 2.2870 1.6090 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7050 0.3320 2.1590 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6810 -0.6130 1.5310 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7510 -2.0070 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -2.5860 2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -0.2880 2.0130 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1250 -1.6170 2.7730 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6090 -1.9920 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 -0.6620 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 0.4420 2.6680 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1680 0.2040 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 1.5430 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 0.5210 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 2.4300 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 1.1820 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 3.5340 0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 0.1220 3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -0.7720 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 0.4750 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3320 -0.4590 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7590 1.5880 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 1.3520 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8840 2.7860 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 0.4410 -2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 2.1870 -2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 -1.4540 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4810 -0.3630 4.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -2.5230 5.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1900 0.9990 8.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -3.3770 8.6380 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3100 -3.6330 7.1620 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3900 -2.2930 6.4260 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3810 -1.4700 7.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 -1.1580 8.4130 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0580 -2.4530 9.2290 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2160 -0.2540 8.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 -4.4350 6.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -4.6180 9.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -2.1490 10.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 7.7610 10.8400 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5250 7.1230 11.8730 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3700 6.4290 11.1460 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6810 7.3800 10.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4920 7.9750 9.3170 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6520 8.7310 9.9700 C 0 0 2 0 0 0 0 0 0 0 0 0 11.8860 5.3820 10.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6470 8.9500 8.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4970 9.2780 8.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4990 8.4730 11.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0060 8.1360 12.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1800 4.1830 8.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1480 3.1740 7.8310 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1890 1.9220 8.7120 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9370 2.2890 10.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 3.1940 10.6170 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8860 4.4970 9.8130 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5450 3.4920 12.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 2.2960 12.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4560 2.8190 6.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0980 5.3840 7.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 4.4820 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 3.9740 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.9190 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 2.8140 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 3.9350 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -0.1470 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -1.1310 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -1.9150 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.2770 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 1.6490 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 2.3940 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 2.4810 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -1.9920 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 -2.6720 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 -3.5480 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4650 -2.7460 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2.0490 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 0.3300 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 2.9550 3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 3.6050 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.9210 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -2.9040 8.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -4.1510 7.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -1.7940 6.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 -0.6440 8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -2.9470 9.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -0.7320 8.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 -0.0890 10.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -4.6360 5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -5.2550 9.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 -2.9250 11.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8930 6.9840 10.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0780 6.3900 12.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6790 6.0100 11.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8870 7.1960 8.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2590 9.5360 10.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 9.7820 9.1250 H 0 0 0 0 0 0 0 0 0 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0 7 77 1 0 0 0 0 7 78 1 0 0 0 0 8 10 1 0 0 0 0 8 79 1 0 0 0 0 8 80 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 81 1 0 0 0 0 11 82 1 0 0 0 0 12 27 1 0 0 0 0 12 83 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 84 1 0 0 0 0 15 85 1 0 0 0 0 16 18 1 0 0 0 0 16 86 1 0 0 0 0 16 87 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 88 1 0 0 0 0 19 89 1 0 0 0 0 20 21 1 0 0 0 0 20 90 1 0 0 0 0 20 91 1 0 0 0 0 21 32 1 0 0 0 0 21 92 1 0 0 0 0 22 35 2 0 0 0 0 22 93 1 0 0 0 0 23 94 1 0 0 0 0 23 95 1 0 0 0 0 23 96 1 0 0 0 0 25 97 1 0 0 0 0 25 98 1 0 0 0 0 25 99 1 0 0 0 0 27100 1 0 0 0 0 28101 1 0 0 0 0 28102 1 0 0 0 0 28103 1 0 0 0 0 29104 1 0 0 0 0 29105 1 0 0 0 0 29106 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33107 1 0 0 0 0 33108 1 0 0 0 0 33109 1 0 0 0 0 34110 1 0 0 0 0 34111 1 0 0 0 0 36112 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 43 1 0 0 0 0 40 47 1 0 0 0 0 40 64 1 0 0 0 0 41 42 1 0 0 0 0 41 46 1 0 0 0 0 41 49 1 0 0 0 0 41113 1 0 0 0 0 42 43 1 0 0 0 0 42 48 1 0 0 0 0 42114 1 0 0 0 0 43 44 1 0 0 0 0 43115 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45116 1 0 0 0 0 46 50 1 0 0 0 0 46117 1 0 0 0 0 47118 1 0 0 0 0 47119 1 0 0 0 0 48120 1 0 0 0 0 49121 1 0 0 0 0 50122 1 0 0 0 0 51 52 1 0 0 0 0 51 56 1 0 0 0 0 51 60 1 0 0 0 0 51123 1 0 0 0 0 52 53 1 0 0 0 0 52 61 1 0 0 0 0 52124 1 0 0 0 0 53 54 1 0 0 0 0 53 57 1 0 0 0 0 53125 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 58 1 0 0 0 0 55126 1 0 0 0 0 56 59 1 0 0 0 0 56127 1 0 0 0 0 57 67 1 0 0 0 0 58128 1 0 0 0 0 58129 1 0 0 0 0 58130 1 0 0 0 0 59131 1 0 0 0 0 60132 1 0 0 0 0 61133 1 0 0 0 0 62 63 1 0 0 0 0 62 67 1 0 0 0 0 62 71 1 0 0 0 0 62134 1 0 0 0 0 63 64 1 0 0 0 0 63 70 1 0 0 0 0 63135 1 0 0 0 0 64 65 1 0 0 0 0 64136 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66137 1 0 0 0 0 67138 1 0 0 0 0 68 69 1 0 0 0 0 68139 1 0 0 0 0 68140 1 0 0 0 0 69141 1 0 0 0 0 70142 1 0 0 0 0 71143 1 0 0 0 0 M END > 74 $$$$ 75 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 144151 0 0 1 0 0 0 0 0999 V2000 -1.8120 3.7450 5.8060 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1730 2.4150 6.4720 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6800 2.4290 7.9220 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1720 2.6960 7.9350 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1120 4.0150 7.2120 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3990 3.9450 5.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 5.0870 7.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 2.2390 6.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 3.7160 4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 1.6300 7.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 1.1640 8.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 7.1990 8.8000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0510 6.3840 7.5390 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1240 7.1040 6.7180 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6380 8.5200 6.3920 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3160 9.2530 7.6970 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6660 8.5140 8.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 10.5550 7.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 9.2260 5.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 6.5170 9.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 6.3880 5.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 7.2130 10.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 15.2980 6.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 12.7320 8.1170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3200 13.5570 9.3540 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8020 14.9420 8.9120 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7090 15.6060 8.0690 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3720 14.7010 6.8810 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0400 13.4200 7.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 11.3680 8.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 15.7440 10.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 16.8690 7.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 12.8980 10.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 13.9320 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 15.3720 -3.8780 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2100 16.1940 -2.6380 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3500 13.9020 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 14.6150 -1.2070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1590 16.0480 -1.5590 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4840 16.8330 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 16.9480 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 14.6630 -0.2860 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7080 15.5540 0.9360 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2460 13.3610 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 13.2660 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 14.2710 2.0860 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6500 15.6650 1.6540 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8230 16.6610 3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 14.3980 2.8610 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1600 15.2390 4.1160 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4810 15.0890 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 13.7040 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 13.1210 3.4890 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7810 12.3020 2.4500 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5230 11.1880 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 13.2100 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 11.8800 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 10.0440 2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 13.8120 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 14.9730 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 13.8110 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 14.6790 4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 14.8710 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 16.2580 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 15.0800 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 16.5150 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 15.9800 -4.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 17.6510 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 15.8480 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 16.6260 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 18.0410 -4.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 18.4550 -2.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 13.6720 4.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 12.5130 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 4.5600 6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 1.5960 5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 3.2160 8.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 2.7620 8.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 4.1880 7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 2.2260 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 3.5070 4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 4.6820 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 2.9370 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.7330 7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 1.1020 9.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 7.2630 9.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 6.2850 6.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 7.1590 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 8.4640 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 9.3440 8.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 10.1320 5.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 5.4840 9.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 6.5330 9.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 6.8240 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 6.8340 11.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 12.5910 7.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 13.6630 9.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 14.8390 8.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 15.7540 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 14.5870 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 11.5040 9.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 10.8800 9.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 16.6360 9.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 17.3460 7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 13.3670 10.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 13.4030 -4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 13.4210 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 15.3750 -4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 14.4100 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 12.8680 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 16.3520 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 17.8460 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 17.5290 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 17.4650 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 13.7140 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 12.3500 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 12.6540 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 12.7780 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 17.0780 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 17.2880 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 15.1560 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 15.8590 4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 13.0660 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 13.7770 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 11.4140 3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 13.7270 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 13.9430 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 12.6080 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 13.6270 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 14.3730 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 12.8610 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 15.5180 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 13.9200 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 15.0680 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 15.6090 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 16.3380 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 17.2470 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 15.5340 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 16.1880 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 16.3400 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 14.7690 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 16.3830 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 17.6380 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 18.9740 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 75 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 76 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 77 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 78 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 79 1 0 0 0 0 7 13 1 0 0 0 0 8 80 1 0 0 0 0 9 81 1 0 0 0 0 9 82 1 0 0 0 0 9 83 1 0 0 0 0 10 84 1 0 0 0 0 11 85 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 20 1 0 0 0 0 12 86 1 0 0 0 0 13 14 1 0 0 0 0 13 87 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 88 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 89 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 90 1 0 0 0 0 18 30 1 0 0 0 0 19 91 1 0 0 0 0 20 22 1 0 0 0 0 20 92 1 0 0 0 0 20 93 1 0 0 0 0 21 94 1 0 0 0 0 22 95 1 0 0 0 0 23 28 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 30 1 0 0 0 0 24 96 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 25 97 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 98 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 99 1 0 0 0 0 28 29 1 0 0 0 0 28100 1 0 0 0 0 30101 1 0 0 0 0 30102 1 0 0 0 0 31103 1 0 0 0 0 32104 1 0 0 0 0 33105 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 34106 1 0 0 0 0 34107 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 35108 1 0 0 0 0 36 39 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 37 38 1 0 0 0 0 37109 1 0 0 0 0 37110 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38 59 1 0 0 0 0 39 40 1 0 0 0 0 39 66 1 0 0 0 0 40 41 1 0 0 0 0 40111 1 0 0 0 0 40112 1 0 0 0 0 41 43 1 0 0 0 0 41113 1 0 0 0 0 41114 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 42 65 1 0 0 0 0 43 47 1 0 0 0 0 43 60 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44115 1 0 0 0 0 44116 1 0 0 0 0 45117 1 0 0 0 0 45118 1 0 0 0 0 46 47 1 0 0 0 0 46 49 1 0 0 0 0 46 61 1 0 0 0 0 47 64 1 0 0 0 0 47 70 1 0 0 0 0 48 50 1 0 0 0 0 48 70 1 0 0 0 0 48119 1 0 0 0 0 48120 1 0 0 0 0 49 50 1 0 0 0 0 49 53 1 0 0 0 0 49 63 1 0 0 0 0 50 51 1 0 0 0 0 50 62 1 0 0 0 0 51 52 1 0 0 0 0 51121 1 0 0 0 0 51122 1 0 0 0 0 52 53 1 0 0 0 0 52123 1 0 0 0 0 52124 1 0 0 0 0 53 54 1 0 0 0 0 53 74 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 55 58 2 0 0 0 0 55125 1 0 0 0 0 56126 1 0 0 0 0 56127 1 0 0 0 0 56128 1 0 0 0 0 59129 1 0 0 0 0 59130 1 0 0 0 0 59131 1 0 0 0 0 60132 1 0 0 0 0 60133 1 0 0 0 0 60134 1 0 0 0 0 62 73 2 0 0 0 0 64135 1 0 0 0 0 64136 1 0 0 0 0 64137 1 0 0 0 0 67138 1 0 0 0 0 68 71 1 0 0 0 0 68 72 2 0 0 0 0 69139 1 0 0 0 0 69140 1 0 0 0 0 69141 1 0 0 0 0 70142 1 0 0 0 0 70143 1 0 0 0 0 71144 1 0 0 0 0 M END > 75 $$$$ ATCMD MOE2008 3D 50 51 0 0 1 0 0 0 0 0999 V2000 -3.0880 0.0180 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 0.0930 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 0.5240 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -1.4680 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -1.5180 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -1.9750 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -2.1920 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -2.2970 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -1.9960 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 0.7520 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 1.0150 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -2.5870 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -3.2750 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -3.0940 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -1.7070 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.6930 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 1.3740 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 1.9840 1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 2.0600 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.7550 0.5790 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4400 0.1620 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.0580 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.4350 -0.5160 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3010 -1.2420 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -2.5270 0.3910 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9340 -2.6120 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -3.7580 -0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -3.6560 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -2.2290 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -0.0830 0.1680 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9130 0.5000 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -4.5760 -1.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -1.8400 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -2.5620 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -0.7980 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.3430 1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 0.5020 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 2.4990 -2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.0940 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 3.2620 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 2.5400 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 3.0480 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 3.7830 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 3.1390 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 2.0550 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 4.6550 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 5.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 4.8180 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 4.7770 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 3.9480 2.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 38 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 32 2 0 0 0 0 29 33 2 0 0 0 0 30 31 1 0 0 0 0 30 36 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 36 37 1 0 0 0 0 39 40 1 0 0 0 0 39 50 2 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 46 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M END > 76 $$$$ 77 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 2.0650 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 1.4700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -0.6640 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 0.0880 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -0.5550 -0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6950 -1.9300 0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -2.6750 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.1640 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -0.7850 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -0.5330 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -3.8170 0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9000 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 2.0670 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 0.0170 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -2.3290 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -2.5420 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.5220 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.9680 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -1.7370 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.2150 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 0.4990 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -0.9980 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.0840 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 3 6 2 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 M END > 77 $$$$ ATCMD MOE2008 3D 60 61 0 0 1 0 0 0 0 0999 V2000 0.3440 2.0510 -1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 0.9510 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.3040 -3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -3.5060 0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -4.0510 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -2.9660 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.0890 0.7030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1190 -1.8540 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -1.7170 -0.7380 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1900 -1.7160 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -0.3600 -0.9030 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8450 -0.2960 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -1.3800 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -0.6000 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 1.0460 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 1.0750 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 1.0710 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 1.3780 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 1.8470 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -0.2750 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -0.4460 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -0.2220 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.4300 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -5.2300 -0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -3.1930 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.4230 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -4.1770 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -0.3210 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -2.4440 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -1.9670 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -2.9010 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -3.2570 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 0.3750 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 0.1090 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -0.7380 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -0.2920 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 0.5220 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3680 -0.5610 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -1.1560 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 1.3350 -2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 2.2240 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 1.5540 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 1.1760 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 1.0980 0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 0.9740 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 0.9110 -0.6580 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6580 0.9860 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 0.5550 -3.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 3.2400 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 4.0730 -0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 3.5020 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 3.0160 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 4.9990 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 5.5820 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 5.1920 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 5.3750 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 3.0040 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 3.5000 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 1.9280 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 3.1970 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 46 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 48 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 2 0 0 0 0 6 9 1 0 0 0 0 6 25 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 46 1 0 0 0 0 13 14 1 0 0 0 0 13 23 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 45 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 33 34 1 0 0 0 0 33 44 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 40 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 57 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 57 60 1 0 0 0 0 M END > 78 $$$$ 79 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1360 1.9080 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.3840 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.2400 -1.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6060 2.3270 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 1.7070 -1.2660 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1500 0.1800 -1.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8480 -0.4540 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -0.0960 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 2.0860 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 1.4210 -2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9600 1.8180 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 2.1690 -1.0500 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6290 3.3530 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 2.9480 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.2410 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.7650 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.0850 -3.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 0.9200 -2.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 2.1780 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 0.9660 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9110 2.5510 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 3.7420 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 2.2660 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 2.3440 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 0.0280 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 0.0940 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 3.4140 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 1.9760 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.1440 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -1.5380 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -0.0810 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -0.4440 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -0.5740 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 1.7300 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 0.9890 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 2.6830 -3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 3.6080 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 4.2120 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 3.3870 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -2.0620 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -2.2080 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -2.1100 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.2460 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 3.1780 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.4920 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 2.1980 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 0.1210 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 1.2200 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 0.7000 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 1.8420 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 4.0160 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 4.4510 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 M END > 79 $$$$ 80 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3870 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6770 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.1850 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 2.4540 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 3.2350 -1.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9060 3.3950 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 4.5570 -0.8800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 5.4220 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 5.0710 -2.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 4.0660 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 4.2270 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 4.8690 -4.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7280 5.1170 -5.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 4.7850 -6.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7020 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -2.1270 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.0530 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 3.4810 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.7570 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -0.4930 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.1730 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 3.1330 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 1.6020 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 1.5060 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 3.0360 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 2.6930 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 2.4150 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 4.0130 -3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 4.8200 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 6.3970 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 5.6840 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 5.0470 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 3.4490 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 3.2460 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 4.8440 -4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5040 5.1180 -3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 5.5910 -5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6240 4.9610 -7.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -2.5590 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.4500 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -2.4600 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 3.8850 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 3.8180 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 3.8280 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 M END > 80 $$$$ 81 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3890 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4120 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 2.1630 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 1.5110 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 2.2780 -0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9690 1.8250 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 2.0300 -1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 0.7550 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 -0.2310 -0.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 1.3960 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0440 0.9430 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 -0.4200 1.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3210 -1.0450 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6580 -0.4320 3.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -0.6980 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -2.1240 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 2.0520 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 3.4800 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7640 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -0.5160 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 3.2430 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 0.4310 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 3.3430 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 1.8550 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 2.7690 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 0.5720 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -1.1340 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 1.3660 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 1.6130 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 0.9600 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2670 -0.8800 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6710 -2.0500 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2250 -0.8740 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -2.4490 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.4580 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -2.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 3.8830 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 3.8190 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 3.8280 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 10 14 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 81 $$$$ 82 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.4810 1.5850 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 0.0600 1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.3400 0.1560 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8910 2.0800 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.6790 -0.0480 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2040 0.1570 -0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5260 -0.2430 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 0.3790 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 2.1700 -0.3410 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0260 1.8620 -1.8010 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4640 2.2670 -2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 1.5210 -1.1790 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0910 1.8680 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 1.4320 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 0.2730 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -1.8640 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.0600 -2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 0.9550 -0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -0.2880 -2.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 3.5790 -0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 2.3200 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 2.4140 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 1.9410 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 0.0360 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -0.6050 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 2.0250 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 1.8760 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.3790 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -0.2980 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 3.1660 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 1.6360 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -0.2980 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -1.3290 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 0.1160 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 2.0210 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 3.3410 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 1.3480 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 2.9440 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 1.6670 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 0.3580 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.2180 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -2.1500 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -2.3090 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 0.4740 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 3.9550 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 3.3590 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 1.7780 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 2.2790 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 3.0140 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5470 1.4080 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 1.6980 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -0.5000 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 -1.6690 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 -0.0690 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 19 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 M END > 82 $$$$ 83 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.2700 0.7200 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.7720 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -1.1120 -1.4630 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0290 1.5190 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 1.2640 -1.3410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1690 -0.2250 -1.4890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0780 -0.4730 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 0.1560 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 1.9110 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 1.6660 -2.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6400 2.3350 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 3.6330 -1.1790 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8160 3.3070 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 2.6490 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -1.0570 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -2.5760 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.0830 -2.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 1.8850 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 4.2100 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 4.6400 -1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 5.1080 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 1.0200 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 0.9200 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -1.0640 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -1.3380 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 2.5820 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 1.2030 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.5100 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -1.5440 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.0440 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -0.2870 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -0.0300 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 2.0700 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 1.6440 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 2.5540 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 2.6340 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 4.2280 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 2.8080 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -0.0840 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.2080 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -3.2300 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -2.8700 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.6580 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -2.1080 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.9710 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 1.5980 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 1.5300 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 4.4140 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7980 5.1360 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 3.4910 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 4.9770 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 4.7720 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 5.8310 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 M END > 83 $$$$ ATCMD MOE2008 3D 49 50 0 0 1 0 0 0 0 0999 V2000 0.9130 1.2620 0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -3.7200 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -2.4230 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.4190 0.4000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4610 -1.8700 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -1.8940 -0.9280 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1020 -2.5100 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -0.4300 -1.3160 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7580 -0.5190 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -2.2690 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -2.0800 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 1.2200 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 1.8240 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 0.2720 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 0.1540 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 0.7670 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.1100 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -0.9530 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -1.6480 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -1.9700 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 1.4020 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -2.3050 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -2.8230 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -2.9810 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -1.4030 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 0.1040 -2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -0.4880 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -1.9260 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -2.4690 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -0.9650 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -4.6020 0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -3.7520 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 2.3610 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.1470 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 0.5780 -0.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5280 -0.0040 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 3.3020 -1.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 2.2800 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 2.8220 -1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 2.6730 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 1.7510 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 3.4920 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 4.4060 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 3.7770 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.9220 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 3.4470 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 4.3880 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 2.8590 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 3.6820 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 31 2 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 28 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 35 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 22 1 0 0 0 0 21 33 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 33 34 1 0 0 0 0 33 37 2 0 0 0 0 35 36 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 46 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M END > 84 $$$$ 85 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 77 81 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 3.4790 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0070 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5460 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0190 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.5930 -1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9540 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8420 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 5.4350 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9710 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.5850 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -0.4740 -3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 0.2420 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -0.4160 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -1.7840 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -2.4930 -3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -1.8420 -3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -3.9800 -3.3750 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2610 0.2800 -1.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 -0.4610 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -7.4000 -7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -6.4940 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -5.7100 -8.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -5.8310 -9.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -6.7420 -10.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -7.5280 -9.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -6.3580 -6.0340 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2200 -6.8640 -11.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -8.4210 -9.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -9.1950 -8.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 -6.0320 -5.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -5.1950 -4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -5.2080 -5.3950 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9090 -4.2640 -4.8100 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1490 -4.6080 -3.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -5.7340 -4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 -3.3590 -5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -4.7120 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 0.1650 -3.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -0.6350 -4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -5.0600 -10.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -4.1450 -10.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.4090 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9100 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 3.6160 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 3.9780 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 1.5880 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5220 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 4.7960 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8370 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7130 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -2.2960 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -2.3990 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1410 -4.3950 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1700 0.2120 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -1.2250 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 -0.9370 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -8.0130 -7.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6290 -5.0030 -8.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -7.2910 -5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -7.5200 -11.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -9.7810 -8.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -8.5300 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -9.8660 -8.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -5.7990 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 -4.6140 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -6.0240 -4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 -6.5740 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.1070 -5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.4030 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.0030 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -3.5930 -11.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -3.4470 -9.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 -4.6980 -9.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 8 51 1 0 0 0 0 9 52 1 0 0 0 0 10 53 1 0 0 0 0 11 54 1 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 56 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 22 61 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 62 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 30 1 0 0 0 0 28 32 1 0 0 0 0 28 34 1 0 0 0 0 28 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 33 1 0 0 0 0 33 35 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 34 39 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 40 41 1 0 0 0 0 41 72 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 42 43 1 0 0 0 0 43 75 1 0 0 0 0 43 76 1 0 0 0 0 43 77 1 0 0 0 0 M END > 85 $$$$ 86 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 104109 0 0 1 0 0 0 0 0999 V2000 0.2840 1.4480 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 2.1800 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 1.5700 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 0.2210 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -0.5110 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 0.1070 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -1.8300 -0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.5200 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 -0.3810 -0.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 2.2900 0.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.6710 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -0.9690 0.8140 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7580 0.0540 1.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -0.4310 3.0250 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5990 -1.1390 2.7910 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3970 -2.2760 1.7840 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8110 -1.6990 0.4920 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4680 0.7440 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 1.3340 4.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 -2.8960 1.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -2.7610 -0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -1.6750 4.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 8.5400 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 8.4100 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 7.2840 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 6.2910 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 6.4160 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 7.5390 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 7.6620 1.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 6.5940 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 9.3870 -0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 9.1870 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 3.0990 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 4.4580 -1.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 5.0680 -1.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5070 2.6520 -1.3740 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2310 3.9880 -1.0360 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1300 4.0840 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 3.2800 0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 2.1140 0.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3840 1.6740 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 4.0430 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 9.6470 1.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 10.8360 4.9470 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6280 10.8700 3.6630 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8930 9.5960 2.8570 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2900 9.4940 2.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 9.4100 3.7370 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9410 10.6770 4.5780 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5800 9.2770 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 12.0540 5.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 10.9450 3.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 10.5710 5.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 8.0380 2.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 3.2280 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.4610 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -3.5620 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -2.4720 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -2.0510 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 4.1800 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 3.7590 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 4.1270 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.6780 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -1.1330 3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -0.4280 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 -3.0130 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -0.9990 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 0.3860 4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 1.4880 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 2.0860 4.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -3.6260 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 -2.4680 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9230 -2.1390 3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 7.1820 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 5.6380 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 6.8180 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 5.6670 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 6.4840 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 9.0940 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 8.2760 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 10.0380 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 3.0640 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 2.4670 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 5.3300 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 5.1180 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 3.6800 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 1.4140 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 0.7730 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 1.4110 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 2.1420 -3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 3.9110 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 3.2490 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 5.0100 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 9.9930 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 11.7410 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 8.7280 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 8.5400 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 11.5440 4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 9.3020 4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 10.1020 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 12.2230 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 10.9710 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 11.3390 6.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 7.8860 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 8 57 1 0 0 0 0 8 58 1 0 0 0 0 8 59 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 60 1 0 0 0 0 11 61 1 0 0 0 0 11 62 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 63 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 64 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 65 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 66 1 0 0 0 0 17 21 1 0 0 0 0 17 67 1 0 0 0 0 18 19 1 0 0 0 0 18 68 1 0 0 0 0 18 69 1 0 0 0 0 19 70 1 0 0 0 0 20 71 1 0 0 0 0 21 72 1 0 0 0 0 22 73 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 74 1 0 0 0 0 26 27 2 0 0 0 0 26 35 1 0 0 0 0 27 28 1 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 32 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 33 34 1 0 0 0 0 33 36 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 34 35 1 0 0 0 0 35 37 1 0 0 0 0 35 84 1 0 0 0 0 36 37 1 0 0 0 0 36 40 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 37 42 1 0 0 0 0 38 39 1 0 0 0 0 38 85 1 0 0 0 0 38 86 1 0 0 0 0 39 40 1 0 0 0 0 40 87 1 0 0 0 0 41 88 1 0 0 0 0 41 89 1 0 0 0 0 41 90 1 0 0 0 0 42 91 1 0 0 0 0 42 92 1 0 0 0 0 42 93 1 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 44 49 1 0 0 0 0 44 51 1 0 0 0 0 44 94 1 0 0 0 0 45 46 1 0 0 0 0 45 52 1 0 0 0 0 45 95 1 0 0 0 0 46 47 1 0 0 0 0 46 96 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 97 1 0 0 0 0 49 53 1 0 0 0 0 49 98 1 0 0 0 0 50 54 1 0 0 0 0 50 99 1 0 0 0 0 50100 1 0 0 0 0 51101 1 0 0 0 0 52102 1 0 0 0 0 53103 1 0 0 0 0 54104 1 0 0 0 0 M END > 86 $$$$ 87 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 126132 0 0 1 0 0 0 0 0999 V2000 0.4470 1.6490 0.2170 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4060 0.1180 0.1940 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1330 -0.3850 -1.0560 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4760 0.1060 -1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 1.5310 -1.0810 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9060 2.1110 0.1680 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0500 1.9380 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 1.4960 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 3.5380 0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 2.1250 1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -0.3230 0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.8140 -1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 6.3470 2.6000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1760 5.6760 1.2230 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0030 4.1650 1.3990 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7860 3.9060 2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 4.4690 3.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8620 5.9920 3.3200 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5900 4.1050 4.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 2.6910 4.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 6.5530 4.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 7.7650 2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 5.9410 0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -2.5860 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -2.3890 -2.2390 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0250 -3.7210 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -3.4640 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -4.8200 -1.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2980 -4.7660 -1.4710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7470 -6.1180 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -7.0220 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -6.0540 -1.2770 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0040 -7.2750 -1.9770 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9490 -7.0180 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -5.7660 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -8.2310 -2.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0210 -7.8980 -2.8900 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6580 -9.3000 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -9.0340 -3.1100 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0420 -9.8530 -3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 -10.7650 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -9.9690 -2.3910 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7620 -11.7890 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9380 -13.7790 -4.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5510 -12.5730 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5740 -14.8160 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 -13.3590 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7700 -12.2050 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 -9.1460 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -9.1900 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -7.0010 -4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 -5.7960 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -3.4520 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -4.1960 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 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-4.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5090 -10.0840 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 -10.6570 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4470 -11.2720 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -12.4700 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -14.2120 -5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 -14.3840 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 -15.6890 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 -15.1150 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -12.6210 -5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 -14.2320 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -12.9270 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3360 -12.7670 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2100 -11.3400 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 -8.4580 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4650 -8.5790 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -9.8130 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -8.7040 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -10.0930 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -9.4540 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 -6.0000 -3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -7.4170 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -6.9510 -4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -5.4580 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -6.4130 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.7210 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -4.3810 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -3.0630 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -4.3250 -3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -5.1480 -4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -3.4560 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 1 57 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 60 1 0 0 0 0 6 9 1 0 0 0 0 6 61 1 0 0 0 0 7 8 1 0 0 0 0 7 62 1 0 0 0 0 7 63 1 0 0 0 0 8 64 1 0 0 0 0 9 15 1 0 0 0 0 10 65 1 0 0 0 0 11 66 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 22 1 0 0 0 0 13 67 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 68 1 0 0 0 0 15 16 1 0 0 0 0 15 69 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 70 1 0 0 0 0 18 21 1 0 0 0 0 18 71 1 0 0 0 0 19 20 1 0 0 0 0 19 72 1 0 0 0 0 19 73 1 0 0 0 0 20 74 1 0 0 0 0 21 75 1 0 0 0 0 22 76 1 0 0 0 0 23 77 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 78 1 0 0 0 0 24 79 1 0 0 0 0 25 26 1 0 0 0 0 25 80 1 0 0 0 0 26 29 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 81 1 0 0 0 0 27 82 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 83 1 0 0 0 0 30 31 1 0 0 0 0 30 84 1 0 0 0 0 30 85 1 0 0 0 0 31 33 1 0 0 0 0 31 86 1 0 0 0 0 31 87 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 32 52 1 0 0 0 0 33 37 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 88 1 0 0 0 0 34 89 1 0 0 0 0 35 90 1 0 0 0 0 35 91 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 36 50 1 0 0 0 0 37 38 1 0 0 0 0 37 51 1 0 0 0 0 38 40 1 0 0 0 0 38 92 1 0 0 0 0 38 93 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 39 56 1 0 0 0 0 40 94 1 0 0 0 0 40 95 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 96 1 0 0 0 0 41 97 1 0 0 0 0 42 49 1 0 0 0 0 42 98 1 0 0 0 0 43 45 1 0 0 0 0 43 99 1 0 0 0 0 43100 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 44101 1 0 0 0 0 45 48 2 0 0 0 0 46102 1 0 0 0 0 46103 1 0 0 0 0 46104 1 0 0 0 0 47105 1 0 0 0 0 47106 1 0 0 0 0 47107 1 0 0 0 0 48108 1 0 0 0 0 48109 1 0 0 0 0 49110 1 0 0 0 0 49111 1 0 0 0 0 49112 1 0 0 0 0 50113 1 0 0 0 0 50114 1 0 0 0 0 50115 1 0 0 0 0 51116 1 0 0 0 0 51117 1 0 0 0 0 51118 1 0 0 0 0 52119 1 0 0 0 0 52120 1 0 0 0 0 53121 1 0 0 0 0 53122 1 0 0 0 0 53123 1 0 0 0 0 54124 1 0 0 0 0 54125 1 0 0 0 0 54126 1 0 0 0 0 M END > 87 $$$$ 88 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 127133 0 0 1 0 0 0 0 0999 V2000 1.5380 -0.2200 1.3340 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3100 -1.6940 0.9810 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9910 -2.0010 -0.3550 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3830 -1.6910 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -0.3170 0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0440 0.0580 1.3710 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1710 -0.0990 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -0.3380 -1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 1.4450 1.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.0570 2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -1.9480 0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -3.3870 -0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 3.6040 4.6580 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7310 3.2500 3.1690 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3700 1.7700 3.0160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1190 1.5170 3.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 1.7850 5.0630 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4300 3.2660 5.2980 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7450 1.4540 5.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 0.0500 5.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 3.5250 6.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 5.0010 4.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 3.4940 2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -4.1680 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -3.7580 -1.9490 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5040 -4.9200 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -4.5220 -3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -5.6260 -3.8090 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0090 -5.2690 -3.9020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2760 -6.4970 -4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -6.7340 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -6.5880 -4.8170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2260 -7.2750 -5.8580 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9920 -6.3750 -6.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -6.4390 -5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -7.5360 -7.2440 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7910 -7.1680 -7.2500 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2190 -8.1460 -8.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -7.7030 -8.7280 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2990 -8.1460 -9.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -9.0360 -10.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -8.7780 -8.9130 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8720 -10.1780 -10.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 -12.3590 -11.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -11.2170 -11.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 -13.6450 -10.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -12.5360 -12.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 -8.3010 -8.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -8.8370 -6.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -5.7380 -7.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -7.0590 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -6.1370 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.5090 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7060 -12.0760 -10.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.0690 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -8.3350 -5.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 -6.7560 -9.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 0.4120 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -2.3250 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -1.3980 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 0.3070 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -0.5390 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 0.9270 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 -0.7870 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -0.2180 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.1040 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.8630 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 3.0290 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 3.8620 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 1.1580 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 1.1730 5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 3.8780 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 1.7410 6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 2.0000 5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -0.2330 5.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 4.4450 6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 5.2870 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 3.2900 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -3.3430 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -5.0360 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -2.9060 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -3.6420 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -4.8790 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -7.3650 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -6.3080 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -7.4520 -6.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -5.7930 -6.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -5.4300 -6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -6.4740 -6.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 -5.5270 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -7.2850 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -9.1410 -7.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -7.7840 -8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -9.1480 -9.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -7.4430 -10.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -9.2890 -10.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -8.1390 -10.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -9.6990 -8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -10.1400 -10.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 -11.2550 -11.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 -13.8610 -11.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5730 -14.4710 -11.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 -13.5190 -9.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 -11.6200 -13.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5020 -13.3630 -13.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 -12.7520 -13.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 -7.3560 -8.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -8.1600 -7.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7830 -9.0470 -8.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -8.7330 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -9.6550 -6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5930 -9.0500 -6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -5.0360 -7.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -5.6180 -8.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -5.5430 -7.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -7.2070 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -7.7360 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -5.8840 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -6.9630 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -6.4300 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -3.6460 -3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -5.3380 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -4.2520 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1550 -11.2730 -11.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -3.1830 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -4.2680 -5.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -3.9030 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 1 58 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 3 60 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 61 1 0 0 0 0 6 9 1 0 0 0 0 6 62 1 0 0 0 0 7 8 1 0 0 0 0 7 63 1 0 0 0 0 7 64 1 0 0 0 0 8 65 1 0 0 0 0 9 15 1 0 0 0 0 10 66 1 0 0 0 0 11 67 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 22 1 0 0 0 0 13 68 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 69 1 0 0 0 0 15 16 1 0 0 0 0 15 70 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 71 1 0 0 0 0 18 21 1 0 0 0 0 18 72 1 0 0 0 0 19 20 1 0 0 0 0 19 73 1 0 0 0 0 19 74 1 0 0 0 0 20 75 1 0 0 0 0 21 76 1 0 0 0 0 22 77 1 0 0 0 0 23 78 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 79 1 0 0 0 0 24 80 1 0 0 0 0 25 26 1 0 0 0 0 25 81 1 0 0 0 0 26 29 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 82 1 0 0 0 0 27 83 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 84 1 0 0 0 0 30 85 1 0 0 0 0 31 33 1 0 0 0 0 31 86 1 0 0 0 0 31 87 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 32 51 1 0 0 0 0 33 37 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 88 1 0 0 0 0 34 89 1 0 0 0 0 35 90 1 0 0 0 0 35 91 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 36 49 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 38 40 1 0 0 0 0 38 92 1 0 0 0 0 38 93 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 39 57 1 0 0 0 0 40 94 1 0 0 0 0 40 95 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 96 1 0 0 0 0 41 97 1 0 0 0 0 42 48 1 0 0 0 0 42 98 1 0 0 0 0 43 45 2 0 0 0 0 43 99 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 44 54 1 0 0 0 0 45100 1 0 0 0 0 46101 1 0 0 0 0 46102 1 0 0 0 0 46103 1 0 0 0 0 47104 1 0 0 0 0 47105 1 0 0 0 0 47106 1 0 0 0 0 48107 1 0 0 0 0 48108 1 0 0 0 0 48109 1 0 0 0 0 49110 1 0 0 0 0 49111 1 0 0 0 0 49112 1 0 0 0 0 50113 1 0 0 0 0 50114 1 0 0 0 0 50115 1 0 0 0 0 51116 1 0 0 0 0 51117 1 0 0 0 0 52118 1 0 0 0 0 52119 1 0 0 0 0 52120 1 0 0 0 0 53121 1 0 0 0 0 53122 1 0 0 0 0 53123 1 0 0 0 0 54124 1 0 0 0 0 55125 1 0 0 0 0 55126 1 0 0 0 0 55127 1 0 0 0 0 M END > 88 $$$$ ATCMD MOE2008 3D 61 62 0 0 1 0 0 0 0 0999 V2000 -0.5410 0.5390 -0.4160 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2530 0.0840 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.5560 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.2890 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.2400 2.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 2.4890 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 2.6100 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 2.8390 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 1.6870 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 3.4330 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 2.3150 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.4230 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 2.2230 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 3.1890 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 3.7090 1.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 3.6750 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -3.7490 0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -3.5650 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -2.2770 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.4760 0.3240 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8280 -1.8870 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -2.4910 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -2.6520 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 0.3470 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 0.6450 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 0.7570 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -1.1890 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -1.4680 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -1.5150 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -1.8960 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -4.3360 1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -1.6730 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -2.1100 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -0.7320 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 0.0770 -1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -1.7520 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -1.8960 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.7650 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -2.5080 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 1.2230 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.9060 -0.4090 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8390 -2.5840 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.5180 -1.0750 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0840 -0.7640 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.3830 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 0.2700 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -0.4450 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 1.5790 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 2.3010 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 2.0370 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 1.4040 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 0.5100 -4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 1.1850 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.4280 -4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 0.9490 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -1.2540 -3.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 2.1400 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 2.3840 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 1.0830 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.6310 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 2.6100 -3.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 40 1 0 0 0 0 1 43 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 2 0 0 0 0 19 32 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 22 23 1 0 0 0 0 22 30 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 24 59 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 36 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 35 43 1 0 0 0 0 35 45 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 57 1 0 0 0 0 40 59 2 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 45 56 2 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 52 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 57 58 1 0 0 0 0 57 61 2 0 0 0 0 59 60 1 0 0 0 0 M END > 89 $$$$ ATCMD MOE2008 3D 52 53 0 0 1 0 0 0 0 0999 V2000 0.4290 -3.2400 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -1.8420 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -1.8550 0.4650 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7450 -1.7670 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.9710 -0.7850 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2090 -1.0010 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.5070 -0.5600 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3870 0.9580 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -1.4850 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.9290 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 1.1900 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 1.4020 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 0.6300 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 1.4760 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 0.1780 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -0.4310 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 -0.9630 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 0.1000 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -1.4380 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -4.2500 -1.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -1.5310 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -2.3010 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -0.5060 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 0.5340 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -2.2110 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -2.6700 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -3.0250 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -1.5670 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -3.1940 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.1880 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 1.1430 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 1.8630 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -0.2480 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -1.0010 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -0.2750 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -0.5450 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 1.5770 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.8630 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 2.5520 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 1.6620 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 1.7050 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 1.4760 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 2.0370 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 2.6750 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 1.8100 -2.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 1.3950 0.1390 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0720 1.0600 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 2.7330 0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 3.4760 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 3.5760 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 4.4750 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 2.9990 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 2 0 0 0 0 1 29 1 0 0 0 0 2 5 1 0 0 0 0 2 21 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 46 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 42 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 30 31 1 0 0 0 0 30 41 2 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 37 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 42 43 1 0 0 0 0 42 46 1 0 0 0 0 43 44 1 0 0 0 0 43 45 2 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M END > 90 $$$$ 91 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 1.6240 3.3220 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 2.2700 -0.4940 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5180 1.0710 0.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9740 2.7110 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 1.5930 1.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8430 0.5470 0.9510 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6940 -0.6380 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -1.3270 2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.9360 1.7960 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0880 -0.3560 2.5980 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5260 1.2720 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 1.9120 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -0.0410 3.2170 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4850 -1.0030 2.5840 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4480 -2.3480 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -2.9680 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8560 -0.7180 3.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7560 -1.9680 4.1420 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2230 -2.3970 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -1.1020 4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 0.0320 3.9660 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3220 1.8110 -1.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 2.4780 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 2.0590 -4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 3.4130 -2.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.0180 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 1.4220 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.1470 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 2.2320 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.7060 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.1030 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 -1.2880 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 0.2090 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -1.6600 5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6260 1.0610 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 0.6300 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6210 2.3260 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7640 1.7750 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -0.5240 5.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -2.6470 6.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.0820 -0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 0.2060 -1.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 4.1280 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.7600 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 2.7150 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 2.2880 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 3.4800 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -0.3250 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -1.3660 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -2.1920 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -1.6580 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8810 1.1210 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1950 1.9740 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 2.8180 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 2.1880 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -2.2580 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -3.0360 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -3.8830 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2400 -3.2190 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1880 -0.9960 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -2.8980 5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 -3.0540 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 -0.9350 5.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7340 -1.1350 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 0.4860 4.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 1.3210 -4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 2.9300 -4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 1.6230 -4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 1.5720 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 0.6080 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 2.3360 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 2.8660 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 1.4520 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 2.8370 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -1.0150 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 0.6930 4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 0.1910 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -0.3540 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 -1.7460 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -1.9660 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 -0.0680 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4970 0.1440 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0650 3.0620 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 2.6350 4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1810 1.5730 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 -2.4000 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -0.5130 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 45 1 0 0 0 0 3 6 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 10 1 0 0 0 0 8 50 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 54 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 56 1 0 0 0 0 15 57 1 0 0 0 0 16 18 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 20 21 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 21 35 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 26 41 2 0 0 0 0 26 42 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 34 39 2 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 38 85 1 0 0 0 0 40 86 1 0 0 0 0 42 87 1 0 0 0 0 M END > 91 $$$$ 92 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 149156 0 0 1 0 0 0 0 0999 V2000 1.1940 3.6520 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 2.5510 -0.7350 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3730 1.2750 0.1140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6340 3.1760 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 1.9740 1.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7960 0.8720 0.4390 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8830 -0.3850 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.9190 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 1.4610 1.0640 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2980 0.1210 1.7590 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5150 2.0250 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 2.5010 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 0.6660 2.1410 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7450 -0.3600 1.5440 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9350 -1.7470 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 -2.2110 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 0.1470 1.9880 C 0 0 3 0 0 0 0 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0 0 0 0 16 18 1 0 0 0 0 16 90 1 0 0 0 0 16 91 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 92 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 93 1 0 0 0 0 19 94 1 0 0 0 0 20 21 1 0 0 0 0 20 95 1 0 0 0 0 20 96 1 0 0 0 0 21 35 1 0 0 0 0 21 97 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 98 1 0 0 0 0 24 99 1 0 0 0 0 24100 1 0 0 0 0 26 41 2 0 0 0 0 26 42 1 0 0 0 0 27101 1 0 0 0 0 27102 1 0 0 0 0 27103 1 0 0 0 0 29104 1 0 0 0 0 29105 1 0 0 0 0 29106 1 0 0 0 0 31107 1 0 0 0 0 31108 1 0 0 0 0 31109 1 0 0 0 0 32110 1 0 0 0 0 32111 1 0 0 0 0 32112 1 0 0 0 0 34 39 2 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 1 0 0 0 0 36113 1 0 0 0 0 36114 1 0 0 0 0 37115 1 0 0 0 0 37116 1 0 0 0 0 38117 1 0 0 0 0 40 69 1 0 0 0 0 42118 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 43 50 1 0 0 0 0 43119 1 0 0 0 0 44 45 1 0 0 0 0 44 49 1 0 0 0 0 44120 1 0 0 0 0 45 46 1 0 0 0 0 45 53 1 0 0 0 0 45121 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 47 51 1 0 0 0 0 47122 1 0 0 0 0 48 52 1 0 0 0 0 48123 1 0 0 0 0 49124 1 0 0 0 0 50125 1 0 0 0 0 51126 1 0 0 0 0 51127 1 0 0 0 0 51128 1 0 0 0 0 52129 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 54 61 1 0 0 0 0 54130 1 0 0 0 0 54131 1 0 0 0 0 55132 1 0 0 0 0 56 57 1 0 0 0 0 56 61 1 0 0 0 0 56133 1 0 0 0 0 57 58 1 0 0 0 0 57 62 1 0 0 0 0 57134 1 0 0 0 0 58 59 1 0 0 0 0 58 63 1 0 0 0 0 58135 1 0 0 0 0 59 60 1 0 0 0 0 59 64 1 0 0 0 0 59136 1 0 0 0 0 60 61 1 0 0 0 0 61137 1 0 0 0 0 62138 1 0 0 0 0 63139 1 0 0 0 0 64 65 1 0 0 0 0 65 71 1 0 0 0 0 65140 1 0 0 0 0 65141 1 0 0 0 0 66 67 1 0 0 0 0 66 71 1 0 0 0 0 66 72 1 0 0 0 0 66142 1 0 0 0 0 67 68 1 0 0 0 0 67 73 1 0 0 0 0 67143 1 0 0 0 0 68 69 1 0 0 0 0 68 74 1 0 0 0 0 68144 1 0 0 0 0 69 70 1 0 0 0 0 69145 1 0 0 0 0 70 71 1 0 0 0 0 71146 1 0 0 0 0 72147 1 0 0 0 0 73148 1 0 0 0 0 74149 1 0 0 0 0 M END > 92 $$$$ 93 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 98103 0 0 1 0 0 0 0 0999 V2000 1.2490 0.7300 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -0.6760 0.9990 O 0 0 0 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0 0 1.9860 -8.7250 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -7.2590 -5.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -9.0320 -7.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -8.8670 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -10.0920 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -7.8720 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -10.6980 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -11.9580 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -10.0730 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -9.6250 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -10.2230 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -12.8570 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -12.9980 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -11.6240 -4.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 8 54 1 0 0 0 0 9 55 1 0 0 0 0 10 56 1 0 0 0 0 11 57 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 58 1 0 0 0 0 13 59 1 0 0 0 0 14 15 1 0 0 0 0 14 60 1 0 0 0 0 14 61 1 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 62 1 0 0 0 0 16 63 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 64 1 0 0 0 0 19 20 1 0 0 0 0 19 65 1 0 0 0 0 19 66 1 0 0 0 0 20 22 1 0 0 0 0 20 67 1 0 0 0 0 20 68 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 69 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 24 72 1 0 0 0 0 25 26 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 75 1 0 0 0 0 26 76 1 0 0 0 0 27 29 2 0 0 0 0 28 77 1 0 0 0 0 28 78 1 0 0 0 0 28 79 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 30 82 1 0 0 0 0 31 32 1 0 0 0 0 31 83 1 0 0 0 0 31 84 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 85 1 0 0 0 0 33 86 1 0 0 0 0 34 87 1 0 0 0 0 35 41 1 0 0 0 0 36 37 1 0 0 0 0 36 43 1 0 0 0 0 36 88 1 0 0 0 0 36 89 1 0 0 0 0 37 90 1 0 0 0 0 38 39 1 0 0 0 0 38 43 1 0 0 0 0 38 44 1 0 0 0 0 38 91 1 0 0 0 0 39 40 1 0 0 0 0 39 45 1 0 0 0 0 39 92 1 0 0 0 0 40 41 1 0 0 0 0 40 46 1 0 0 0 0 40 93 1 0 0 0 0 41 42 1 0 0 0 0 41 94 1 0 0 0 0 42 43 1 0 0 0 0 43 95 1 0 0 0 0 44 96 1 0 0 0 0 45 97 1 0 0 0 0 46 98 1 0 0 0 0 M END > 93 $$$$ 94 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 86 0 0 1 0 0 0 0 0999 V2000 -0.0900 0.0640 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -1.4660 0.6580 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5810 -1.7410 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 0.6320 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -1.1910 -0.8400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2240 -0.0920 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 0.7880 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -0.0450 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 -0.0860 -2.0930 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4440 -1.4390 -1.9860 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0330 -1.5320 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -1.5450 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.6160 1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -0.6440 0.5900 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6160 -3.2710 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -1.1220 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -0.6800 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -2.6170 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 -1.2920 -3.1490 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3620 -0.0240 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 0.4380 -4.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 -2.5310 -3.4960 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6500 -3.3680 -4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -2.5000 -5.7340 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0500 -1.6550 -5.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -0.6680 -4.2610 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6220 -2.1200 -3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 1.0790 -1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -2.0160 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -0.5480 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -3.3980 -6.7890 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7420 -2.5280 -7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 -4.2060 -6.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.7310 -7.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -1.6160 -8.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -3.4250 -8.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 -0.5540 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 0.4920 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.2850 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -2.1000 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 1.3010 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.1690 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -0.5250 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 0.5560 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 1.5120 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 1.3040 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 -2.4790 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -0.7230 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 -2.5720 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 -1.1980 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -3.6820 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -3.4830 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -3.7270 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -0.0450 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.3230 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -1.5550 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 -2.5280 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 -3.5560 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.6020 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 -3.1620 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 -3.9480 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 -4.0660 -4.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8120 -1.8930 -6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 0.0840 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0740 -1.6280 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 -3.0060 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 -1.4330 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 0.9630 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 1.0830 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 2.0190 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 0.4100 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -1.3280 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 -4.0410 -7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -3.6990 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -1.1530 -7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5930 -2.2240 -8.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 -0.9960 -9.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2290 -0.9780 -7.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -4.1320 -8.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -2.8100 -9.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -3.9710 -9.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 40 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 14 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 17 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 30 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 30 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 22 1 0 0 0 0 19 26 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 26 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 73 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 32 36 1 0 0 0 0 33 74 1 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 M END > 94 $$$$ 95 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 1.4280 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6770 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 2.1150 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 1.4940 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.0370 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -0.6290 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 2.1200 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 3.4620 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 11.6670 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 12.4260 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 13.7840 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 14.3960 -2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 13.6420 -3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 12.2830 -3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 15.7320 -2.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 14.5240 -0.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 14.2430 -5.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 10.2160 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 9.5560 -3.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 9.6230 -1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 6.3010 0.2140 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6220 7.8200 0.1590 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9280 8.1920 -1.1550 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5970 7.4420 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 6.0360 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 5.6240 0.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8990 8.4590 0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 4.1050 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 5.9360 1.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.1860 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.4360 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -0.8270 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 2.3260 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 11.9520 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 11.6990 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 16.2720 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 14.5840 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 14.2630 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 5.9830 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 8.1450 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 7.9120 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 7.6700 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 7.7530 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 5.9110 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 9.4240 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 3.8100 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 3.8000 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 6.3330 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 33 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 32 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 M END > 95 $$$$ 96 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 83 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3860 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.1920 -0.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5810 3.3510 0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 2.8060 -1.4160 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5770 4.1340 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 4.3590 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 5.5180 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 6.4230 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7950 6.1890 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 5.0420 -1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 5.7560 2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 6.9600 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 7.1800 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 6.8180 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 7.8240 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2670 7.4860 -2.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7020 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.0500 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -2.0380 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 3.4780 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.0280 -1.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5250 -2.6650 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -2.3380 -1.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6790 0.0930 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 0.1670 -0.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 3.0170 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 3.4750 -3.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -3.4150 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -2.1530 -0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -4.2690 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -5.2590 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -5.3920 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -4.5340 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -3.5440 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -6.3640 0.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -6.1000 -1.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -5.9050 -3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.4870 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 1.5560 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 2.1860 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 7.3180 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4870 4.8550 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 6.9520 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 7.8180 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 7.0270 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 7.1530 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 8.1810 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4110 6.8440 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 5.8160 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 7.7970 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7330 8.8250 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 8.0830 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 3.8820 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 3.8160 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 3.8260 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -1.1430 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -2.3580 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -2.3670 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -3.7480 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -2.6330 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 1.0420 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -0.1120 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 0.8580 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 2.0750 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 3.7600 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 3.6300 -4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -1.8890 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -4.1630 -2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -4.6350 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -2.8750 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -6.0870 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -6.0250 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -4.9020 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -6.6400 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 45 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 58 1 0 0 0 0 22 26 1 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 33 1 0 0 0 0 28 34 1 0 0 0 0 28 66 1 0 0 0 0 29 30 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 69 1 0 0 0 0 31 32 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 32 72 1 0 0 0 0 33 35 1 0 0 0 0 33 39 2 0 0 0 0 34 73 1 0 0 0 0 35 36 2 0 0 0 0 35 74 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 40 77 1 0 0 0 0 41 42 1 0 0 0 0 42 78 1 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 M END > 96 $$$$ 97 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6810 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0230 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4040 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0850 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 3.4440 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 3.9200 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.0570 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 3.5120 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 4.8250 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 5.6890 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 5.2390 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 6.0870 0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1850 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6130 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -1.5710 2.3990 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6230 -0.9310 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 0.2390 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 1.2290 4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 2.5670 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -2.2040 3.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -0.5070 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 1.9540 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 2.0320 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 5.1780 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 6.7150 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 6.1030 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -2.5840 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -2.5650 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -3.5810 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -2.6880 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.8000 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -1.6720 4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.5670 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 0.7410 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.1370 4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 0.8320 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 1.3800 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 2.9930 5.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 2.4070 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.6290 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 97 $$$$ 98 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6810 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0230 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4040 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0850 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 3.4440 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 3.9200 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.0570 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 3.5120 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 4.8250 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 5.6890 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 5.2390 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 6.0870 0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1850 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6130 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -1.5710 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -0.9310 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 0.2390 4.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0340 1.2290 4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 2.5670 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.8980 3.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -0.5070 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 1.9540 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 2.0320 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 5.1780 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 6.7150 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 6.1030 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -2.5840 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -2.5650 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -3.5810 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -2.6880 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.8000 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -2.0540 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -1.6720 4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.5670 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.1370 4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 0.8320 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 1.3800 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 2.9930 5.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 2.4070 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 1.6510 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 98 $$$$ 99 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6790 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0320 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4140 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7010 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.0460 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -2.5150 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 2.1760 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 1.6070 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 0.9840 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 0.1820 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -2.5800 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -2.9810 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -3.3140 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -3.3090 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.9080 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -1.2910 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 -1.6670 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -3.6190 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 -2.2980 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9120 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.4920 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1690 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.8980 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 3.2280 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 2.0760 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 0.8450 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 2.4080 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 1.7740 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 0.3220 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 0.4030 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 0.4620 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -2.3170 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -3.0360 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -3.6200 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -2.9010 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -4.2910 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 -4.0850 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 -1.9220 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 -2.4640 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 14 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 19 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END > 99 $$$$ 100 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3890 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6690 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.1140 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -2.1340 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -3.0990 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.4430 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -0.6710 0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.7720 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 2.2020 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4500 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0770 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 0.4170 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 1.2840 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -4.8230 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -3.8580 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -4.2080 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -3.3540 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 -2.0420 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -2.5330 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 -0.8120 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -1.9750 2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 3.1920 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -5.1960 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.8600 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.6330 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 3.0540 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 2.5650 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -0.4440 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 1.0000 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 0.1000 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 0.6470 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 1.8980 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -5.8660 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -4.0110 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -5.2620 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -3.8990 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -3.1590 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -1.7940 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -0.9610 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -0.6480 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 5 1 0 0 0 0 3 12 2 0 0 0 0 4 11 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 20 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 15 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 19 22 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END > 100 $$$$ 101 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3890 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6700 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.1140 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -2.1350 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -3.1110 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -4.4520 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -0.6690 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.7990 -1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 2.2020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4500 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0780 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 0.3940 0.7210 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8240 1.2840 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -4.8210 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -3.8470 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -4.1800 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -3.3230 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -2.0460 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -2.5230 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 -0.8770 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 1.1030 1.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 3.1930 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -5.2120 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -0.8570 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -2.6690 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 3.0590 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 2.5560 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -0.4430 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 0.1280 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 0.6600 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 1.8950 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -5.8630 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -3.9580 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -5.2340 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 -3.8970 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -3.0550 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -1.8320 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 -2.1870 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -1.7740 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -1.1240 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -0.7010 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8990 1.9220 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 5 1 0 0 0 0 3 12 2 0 0 0 0 4 11 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 20 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 15 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 21 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 101 $$$$ 102 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 -0.7690 2.1660 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 0.8470 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 0.4100 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 1.3000 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 2.6190 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 3.0490 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 4.3230 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 4.5300 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 3.4320 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 3.6150 4.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 4.8880 5.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 5.9860 4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 5.8100 3.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 6.8880 2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -1.0450 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -1.7780 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.1020 2.2160 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6260 -0.5360 3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 0.3030 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 1.3300 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 2.4170 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -2.0600 2.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 0.4710 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 1.6160 2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -2.0100 3.0840 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7410 -3.2560 2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -3.3720 2.8810 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5890 -2.0540 2.4690 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2740 -0.9640 3.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -0.7910 2.6570 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7540 -1.9380 2.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -4.4500 2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -4.1250 2.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 5.1940 2.5580 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0560 4.0140 2.9760 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0460 2.8620 3.2580 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2220 3.1890 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 4.6150 2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 4.3410 4.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 6.2860 3.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 5.6360 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 6.7270 0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 2.5080 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 0.1570 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 0.9640 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 3.3150 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 2.4360 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 5.0270 6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 6.9800 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 7.1440 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -1.4820 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -1.1350 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -2.8170 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -1.7380 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.2920 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -1.3560 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.0910 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.8200 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.3500 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 0.8350 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 1.7830 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 2.7080 6.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 2.0330 5.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 0.4060 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 0.5610 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -2.0350 4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -3.5480 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -1.9450 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -0.6960 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3230 -2.6910 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -5.3110 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 3.7460 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 2.8210 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 4.8430 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 5.0110 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 3.6100 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 7.0540 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 5.9520 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 4.8040 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 7.0600 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 31 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 33 2 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 67 1 0 0 0 0 28 29 1 0 0 0 0 28 68 1 0 0 0 0 29 30 1 0 0 0 0 30 69 1 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 34 41 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 72 1 0 0 0 0 36 37 1 0 0 0 0 36 73 1 0 0 0 0 37 38 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 40 77 1 0 0 0 0 41 42 1 0 0 0 0 41 78 1 0 0 0 0 41 79 1 0 0 0 0 42 80 1 0 0 0 0 M END > 102 $$$$ 103 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 3.4790 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0070 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5460 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0190 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.5930 -1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9540 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8420 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 5.4350 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9710 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.5850 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -2.0040 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -0.6390 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 0.2430 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -0.2500 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -1.6180 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -2.4910 -3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 0.5800 -4.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -0.0080 -5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 -0.0340 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1640 -0.7230 -6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7350 -1.3770 -7.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -0.5970 -6.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -3.9740 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -4.2720 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6940 -2.2310 -8.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 -3.6500 -7.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -1.2840 -7.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 -4.0360 -7.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 -4.7820 -5.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -4.8160 -5.2510 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4080 -6.1630 -5.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.4090 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9100 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 3.6160 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 3.9780 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 1.5880 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5220 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 4.7960 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8370 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7130 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -2.6890 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -0.2600 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -2.0020 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 0.4830 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2070 -0.7500 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -0.5190 -7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -4.4950 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -4.3140 -4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 -3.3550 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -5.0120 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -2.2620 -9.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6970 -1.8090 -8.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 -4.3480 -8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3480 -3.6870 -6.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -1.7470 -8.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6690 -3.1350 -7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8390 -4.6790 -7.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6460 -5.8010 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 -4.2700 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -4.2040 -5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -6.2620 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 27 1 0 0 0 0 23 29 1 0 0 0 0 24 29 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 32 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 30 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 M END > 103 $$$$ 104 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 -1.2290 0.0570 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -1.3490 -0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 2.2160 0.4780 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2790 2.8960 0.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0990 2.6740 -0.6380 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2260 1.1710 -0.9000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9220 0.5960 -1.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 0.7310 0.1740 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8300 2.3540 1.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 4.2970 0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 3.2420 -0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 0.9580 -2.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -2.6760 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -1.3670 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -0.3290 -2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -0.6110 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -1.9240 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -2.9520 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 0.3790 -4.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 0.0000 -5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 0.0700 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7550 -0.4160 -5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5280 -0.9620 -6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -0.4740 -6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -4.3720 -3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -4.4580 -3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -1.6040 -7.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -3.0760 -7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -0.9580 -7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -3.6580 -6.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3340 -4.5610 -5.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -4.8160 -5.2510 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0160 -4.0130 -6.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 0.4700 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 0.2370 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -1.8410 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 2.6820 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 2.4640 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 3.1500 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 0.7030 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 0.2570 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 3.2720 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 4.7910 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 3.1380 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -3.4820 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -1.1520 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -2.1440 -4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 0.5030 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 -0.3690 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -0.4660 -6.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -5.0260 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -4.6840 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 -3.4970 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 -5.2260 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4620 -1.5350 -8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -1.0920 -7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2860 -3.6310 -7.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -3.1550 -6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -1.3320 -8.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.8440 -6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 -4.2400 -7.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -5.5090 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 -4.0730 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 -5.8690 -5.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -4.2570 -6.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 27 1 0 0 0 0 23 29 1 0 0 0 0 24 29 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 32 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 30 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 M END > 104 $$$$ 105 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 0.2460 1.1520 -0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -2.4740 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -2.1730 -3.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -2.5220 -0.8510 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4290 -2.1040 0.6060 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1700 -0.5950 0.6590 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0320 -0.2610 -0.2280 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2240 -0.7040 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -2.1130 -1.6800 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8190 -3.9390 -0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.2050 2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.0740 -7.0730 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5940 -1.9610 -6.0850 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4420 -2.5910 -5.2720 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6560 -4.0160 -5.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -4.2450 -6.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -0.8080 -6.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.6420 -8.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -3.4820 -6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -4.5110 -7.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -2.4160 1.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -0.5360 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -0.4080 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 0.6430 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 1.5450 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 1.4210 -3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 0.3930 -3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 0.3350 -5.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 1.1800 -5.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 1.7280 -5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 2.5960 -5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 2.9120 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 2.3640 -7.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 1.4960 -7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 0.9570 -7.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 0.8270 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.7410 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 1.5450 -0.7020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4140 2.8550 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 2.6060 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 3.6650 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 3.1990 -5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -1.8970 -3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -3.5380 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -2.0270 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.6360 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.0610 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -0.7630 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.6400 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -4.2700 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 0.7400 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -1.7020 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -2.3210 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -4.2280 -7.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -5.1960 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.0780 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -3.3020 -9.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -2.6180 -6.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -3.8530 -5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 -4.8190 -7.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -2.1770 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -1.3610 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -1.1290 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 2.3460 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 2.1230 -3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4770 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 3.5880 -7.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 2.6130 -8.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 1.4840 -7.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -0.1410 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 1.2830 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 1.4880 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 2.7800 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 0.7680 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 3.5930 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 3.2260 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 1.6170 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 2.6620 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 4.6040 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 3.8140 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 4.0510 -5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 2.4520 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 9 49 1 0 0 0 0 10 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 26 2 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 26 65 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 42 1 0 0 0 0 32 33 2 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 35 69 1 0 0 0 0 36 37 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 38 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 38 39 1 0 0 0 0 38 74 1 0 0 0 0 39 40 1 0 0 0 0 39 75 1 0 0 0 0 39 76 1 0 0 0 0 40 41 1 0 0 0 0 40 77 1 0 0 0 0 40 78 1 0 0 0 0 41 42 1 0 0 0 0 41 79 1 0 0 0 0 41 80 1 0 0 0 0 42 81 1 0 0 0 0 42 82 1 0 0 0 0 M END > 105 $$$$ 106 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 87 0 0 1 0 0 0 0 0999 V2000 1.8320 1.6130 2.2880 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6060 0.1630 1.8050 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9540 -0.5380 2.0810 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5660 0.2390 3.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 1.6160 2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 0.1420 0.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 2.5320 1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 1.9570 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 3.3010 3.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -1.8820 2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -2.6700 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 -4.8870 3.2620 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5020 -6.3090 3.7020 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5580 -6.9280 2.6670 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3230 -6.0360 2.5160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7310 -4.7210 2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -4.0740 3.0880 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6850 -4.2740 4.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -7.0970 3.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -8.2290 3.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -6.5780 1.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -11.3370 5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -12.6340 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -12.9210 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -11.9150 4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -10.6240 4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -10.3350 5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -9.5290 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -8.8800 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -7.7690 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -7.1200 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -6.0090 1.4990 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0730 -5.2780 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -4.0780 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.3460 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -3.2800 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -3.4820 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -2.7510 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.8140 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -1.6140 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 -13.6210 5.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -1.0940 -4.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.3090 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -0.5260 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 1.9600 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 2.2470 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.7480 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 3.4570 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 1.8570 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.2760 4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 3.5870 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -2.7360 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -2.2030 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 -4.9240 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -6.2760 4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -7.0070 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -5.9910 3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -4.0030 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -4.7400 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 -8.0110 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -8.6800 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -11.1100 5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -13.9300 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -12.1390 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -9.3250 5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -8.7770 5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -9.9510 4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -9.6320 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -8.4580 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -7.0170 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -8.1910 3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -7.8720 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -6.6980 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -5.3030 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -5.9590 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -4.9330 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -3.4490 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -4.4300 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -2.1940 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -4.2110 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -2.9090 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -0.8850 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -13.7360 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -1.5070 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 11 17 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 17 58 1 0 0 0 0 18 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 26 2 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 30 31 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 31 32 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 32 33 1 0 0 0 0 32 74 1 0 0 0 0 33 34 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 36 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 35 79 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 37 80 1 0 0 0 0 38 39 2 0 0 0 0 38 81 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 40 82 1 0 0 0 0 41 83 1 0 0 0 0 42 84 1 0 0 0 0 M END > 106 $$$$ 107 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0410 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4290 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 1.8470 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 3.2370 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 4.0150 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 1.2270 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 1.9930 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 3.3950 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 4.1860 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 3.4760 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 2.1150 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.4050 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -0.1330 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 1.0920 0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 3.8310 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 5.3710 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.6200 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.0350 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 5.4060 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 0.1760 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -0.7730 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 4.1070 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 1.9800 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 4.0100 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 0.8780 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 5.7580 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.4240 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 0.8100 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 0.8000 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -0.4760 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -0.5310 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -0.4240 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -1.8520 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0850 3.1760 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 4.7770 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 4.5800 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 12 2 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 17 25 1 0 0 0 0 18 31 1 0 0 0 0 19 26 1 0 0 0 0 20 32 1 0 0 0 0 21 24 1 0 0 0 0 22 33 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END > 107 $$$$ 108 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 22 21 0 0 0 0 0 0 0 0999 V2000 -0.2500 1.5320 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.0190 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.6570 0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -0.3440 -1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.0770 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -2.6790 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -1.5270 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -1.7480 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 2.0470 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 1.8160 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.8090 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.2650 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -2.4840 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -2.3240 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -3.7620 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -2.2710 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -2.4310 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -1.4160 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.3830 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.6500 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -1.8590 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -0.8920 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 3 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 M END > 108 $$$$ 109 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 9 8 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6620 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.6250 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.1660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.6320 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 M END > 109 $$$$ 110 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.1920 1.4590 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.1730 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.5800 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.3380 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 1.6240 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 2.3150 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 3.5390 -0.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 2.2860 0.1390 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.6670 -1.3280 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.2600 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.5780 -1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -1.9160 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -2.5800 1.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -1.8460 -0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 2.6080 1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 3.5190 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 3.3680 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.3780 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -0.0890 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -0.5150 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -2.0140 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.2250 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -2.6350 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -3.0020 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 3.7800 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 3.0500 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 4.4200 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.9600 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 2.6800 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 4.3310 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 17 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 M END > 110 $$$$ 111 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 14 13 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -0.4760 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.9830 -0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -0.0340 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 0.1280 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -1.4870 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -0.1670 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 14 1 0 0 0 0 M END > 111 $$$$ 112 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0640 1.3110 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0710 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.7460 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 2.0260 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.3590 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -0.0400 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.7280 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8530 0.1230 0.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 2.1210 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 1.4910 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 4.1820 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 3.4620 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 3.6030 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 2.3000 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 1.8870 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 4.3030 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 3.7880 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 2.6190 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 2.4390 1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 3.0810 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5660 4.2000 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -0.7820 0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -0.0360 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.1040 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -2.6590 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -0.4720 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -1.9340 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -1.4690 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -0.2890 2.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -2.4780 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 1.8300 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 3.1060 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -1.0870 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 5.1980 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 3.9340 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 1.0480 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 5.2070 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2980 3.4070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5820 2.4290 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.5790 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.6050 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -0.7220 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.3040 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.3480 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -3.7460 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 -0.5520 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 0.1630 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -1.4640 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -2.6480 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -2.4110 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -3.0690 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -1.9590 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -3.1360 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 6 2 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 2 0 0 0 0 15 18 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END > 112 $$$$ 113 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.1340 1.0940 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.2840 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.9040 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.8600 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.2510 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -0.1450 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -0.7670 0.0920 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8210 0.1310 0.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 2.0650 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 1.4920 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 4.1630 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 3.4010 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 3.6360 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 2.3540 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 2.0200 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 4.3610 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 3.9080 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 2.7790 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 2.6630 0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2010 3.2760 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 4.3500 -0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -1.0470 0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -0.4420 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -2.2570 0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -2.7800 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -0.3590 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -1.0710 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -2.0010 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -1.6020 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -2.6570 3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -0.4380 2.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 1.5670 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 2.9390 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 5.1660 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 3.8330 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 1.2230 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 5.2330 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1560 3.6490 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 2.5900 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -0.5470 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 0.2200 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -1.4210 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -2.4150 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -3.8690 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -2.4530 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 0.3040 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -1.0840 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 0.2280 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -2.7420 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -2.4250 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -3.6410 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -2.4750 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -2.6190 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 6 2 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 2 0 0 0 0 15 18 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 26 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END > 113 $$$$ 114 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.0410 2.1600 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 0.7860 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -0.0880 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 2.7440 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.8850 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 0.4770 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -0.0780 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 2.1200 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 0.9100 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 3.2240 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 3.4350 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 2.0170 -0.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 0.7300 -0.0560 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3150 -0.3690 -0.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 2.1460 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 0.9510 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 -0.2620 -1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -1.3910 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 -1.3060 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 -0.1030 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2910 1.0260 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 3.2260 -1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 0.3360 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 0.2610 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 0.4990 0.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 -0.1100 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -1.6330 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 2.7930 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 0.3820 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -1.1570 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 3.8170 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -1.0300 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 4.0890 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 3.0970 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 3.8020 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 4.1600 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -2.3360 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4560 -2.1870 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6500 -0.0500 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8140 1.9640 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 1.0810 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.6370 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 -1.1920 2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 0.3730 2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 0.2210 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -1.7480 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 -2.4650 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -1.6240 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 6 2 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END > 114 $$$$ 115 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 17 17 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 1.3930 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.5580 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 4.3220 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 4.1570 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7630 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5230 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 1.9360 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 4.0670 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 5.3920 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 4.0580 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 M END > 115 $$$$ 116 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.4170 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.1540 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -2.8860 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 2.1190 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 1.3630 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.4500 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 2.0400 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 1.2450 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.7780 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -0.4860 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -2.6180 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -3.9610 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -2.6090 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 0.7300 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 0.7390 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 2.0430 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.8380 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 1.8960 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 0.6200 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 0.6110 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 M END > 116 $$$$ 117 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3730 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0040 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.0200 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 1.4000 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0890 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.0430 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.5570 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -0.6520 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 4.1750 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 4.2960 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 0.1340 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9010 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 1.9470 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -2.4370 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 3.5830 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 4.8470 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 4.9930 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 0.7620 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 0.7630 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -0.5250 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 8 1 0 0 0 0 7 16 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 M END > 117 $$$$ 118 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 66 0 0 1 0 0 0 0 0999 V2000 0.0200 -0.2010 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 0.8960 0.1200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4220 0.3070 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -1.4490 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -4.5320 0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -4.2400 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -6.9170 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -6.5540 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -5.2860 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.9550 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -1.9750 -0.2780 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6800 -0.8300 -0.5890 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1220 -1.3220 -0.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3750 -2.4560 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 1.6300 -1.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 0.1720 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -4.9230 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -0.1680 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 -0.6110 -0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9190 -1.6360 -1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 0.5710 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 1.0050 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 0.3970 1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 2.1120 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -2.5180 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 -3.6090 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3010 -2.4360 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 2.6820 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 2.9810 -0.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 3.4910 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 1.5760 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 1.0800 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -0.0820 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -2.1570 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -6.6300 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -6.3910 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -7.9920 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -7.3230 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -2.4470 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.4740 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -1.6860 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -2.8180 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -3.2720 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -2.0880 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.7240 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 0.6410 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 0.8710 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -4.9730 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -5.6220 -4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -3.9110 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 0.1170 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 0.6850 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -1.0130 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5790 1.0610 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -0.4950 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 1.1190 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 0.1260 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 3.0030 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5280 2.3360 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8920 1.7980 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 -3.5230 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -3.5140 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0950 -4.5810 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 3.0720 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 4.5230 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 3.4630 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 31 1 0 0 0 0 3 12 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 11 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 28 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 M END > 118 $$$$ 119 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 68 68 0 0 1 0 0 0 0 0999 V2000 1.8540 0.3980 -0.1990 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8270 1.5310 0.1340 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1010 1.5420 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -0.9400 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.9700 2.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -3.1750 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -5.1960 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -5.4510 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -4.4870 2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -2.2000 2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -0.9290 1.7220 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7140 0.2030 2.0550 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9880 0.2140 3.5600 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0820 1.2380 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 1.3260 -0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 0.3870 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -4.7420 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 0.5900 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 0.4860 5.8160 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9010 1.5040 6.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 0.6910 6.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -0.2990 7.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.6770 7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.0590 8.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 1.2260 7.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 2.2350 7.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 0.1670 7.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 2.4220 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 3.5180 -0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 2.2870 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 0.5520 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 2.4840 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 2.3490 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 1.6960 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -1.7470 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -1.0940 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -4.3730 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -4.9370 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -6.0940 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -6.4150 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -0.7750 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 0.0490 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -0.7760 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 2.2440 3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 1.1330 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 1.0680 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -0.4200 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 1.3410 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 0.2330 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -4.4770 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 -5.7960 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -4.1350 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.6120 4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -0.0900 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.5000 6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.6540 6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -1.7590 7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.4220 7.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -1.8480 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 0.9900 7.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.6850 7.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.3080 9.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 3.1210 7.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 2.5130 8.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6800 1.8000 7.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 2.2980 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 3.1190 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 1.3480 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 32 1 0 0 0 0 3 12 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 11 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 28 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 55 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 M END > 119 $$$$ 120 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 110114 0 0 1 0 0 0 0 0999 V2000 -0.0590 -0.1240 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -7.2400 8.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -6.8230 8.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -5.9540 9.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -6.4000 10.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -7.7140 10.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -8.5830 9.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -8.1370 8.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -7.0240 2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -5.7390 2.3310 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0120 -5.9360 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -6.1800 0.0380 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2930 -3.5070 0.1560 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3560 -3.8810 1.2200 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4420 -5.4450 1.3790 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4050 -5.0940 3.7190 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2140 -3.5860 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -3.2800 2.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0840 -3.8440 0.7740 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1840 -7.0620 -0.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2370 -5.3050 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -6.1990 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -5.9500 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -7.8090 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -7.4500 1.9460 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1610 -5.2260 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -3.3660 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -7.0910 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -5.4870 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -5.6710 4.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -5.7450 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -3.2310 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -7.7910 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -2.0580 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -1.8360 2.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -7.8360 3.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -7.0720 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -7.2860 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -8.1990 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -6.7460 -2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -5.7330 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -6.3190 6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -5.3190 6.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -6.3380 7.9540 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0220 -1.6020 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -2.3780 -2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -2.4150 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -1.8240 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -2.1530 1.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -8.3280 7.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -8.1480 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -8.5530 5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -8.1030 3.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -7.7720 9.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -1.2370 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.2570 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -1.8940 4.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 0.3150 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.0360 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 0.3470 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -4.9270 9.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -5.7210 10.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -8.0630 10.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -9.6100 9.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -8.8160 7.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -5.8570 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -5.6090 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -5.4770 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -3.9730 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -5.2900 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -3.1210 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -3.1630 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -3.6940 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -3.4140 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -7.6200 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -8.8850 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -8.0050 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -4.9550 3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -5.8790 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -4.3240 2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -3.8410 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -3.6060 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -2.2860 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -7.9340 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -7.4620 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -6.5070 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -4.7020 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -6.2050 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -5.0470 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -8.5900 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -7.6410 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -9.0260 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -7.3370 6.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -5.7120 6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -5.3320 8.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -0.8720 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -1.6620 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -2.5100 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -8.8080 7.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -9.0610 7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -7.9230 6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -8.5350 5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -9.5600 5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -7.8570 6.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -6.9460 10.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -8.3450 9.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -8.4180 9.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 0.7540 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 0.5590 4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.5380 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 45 1 0 0 0 0 1 58 1 0 0 0 0 1 59 1 0 0 0 0 1 60 1 0 0 0 0 2 44 1 0 0 0 0 2 50 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 61 1 0 0 0 0 5 6 1 0 0 0 0 5 62 1 0 0 0 0 6 7 2 0 0 0 0 6 63 1 0 0 0 0 7 8 1 0 0 0 0 7 64 1 0 0 0 0 8 65 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 66 1 0 0 0 0 11 67 1 0 0 0 0 12 15 1 0 0 0 0 12 20 1 0 0 0 0 12 37 1 0 0 0 0 12 68 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 34 1 0 0 0 0 13 69 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 70 1 0 0 0 0 17 18 1 0 0 0 0 17 71 1 0 0 0 0 17 72 1 0 0 0 0 18 35 1 0 0 0 0 18 73 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 19 74 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 28 1 0 0 0 0 22 29 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 75 1 0 0 0 0 24 76 1 0 0 0 0 25 36 1 0 0 0 0 25 77 1 0 0 0 0 26 78 1 0 0 0 0 26 79 1 0 0 0 0 26 80 1 0 0 0 0 27 81 1 0 0 0 0 27 82 1 0 0 0 0 27 83 1 0 0 0 0 28 84 1 0 0 0 0 28 85 1 0 0 0 0 28 86 1 0 0 0 0 29 87 1 0 0 0 0 29 88 1 0 0 0 0 29 89 1 0 0 0 0 30 41 1 0 0 0 0 32 47 1 0 0 0 0 34 45 1 0 0 0 0 35 55 1 0 0 0 0 36 51 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 90 1 0 0 0 0 39 91 1 0 0 0 0 39 92 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 42 44 1 0 0 0 0 42 93 1 0 0 0 0 42 94 1 0 0 0 0 44 95 1 0 0 0 0 45 46 2 0 0 0 0 47 48 1 0 0 0 0 47 49 2 0 0 0 0 48 96 1 0 0 0 0 48 97 1 0 0 0 0 48 98 1 0 0 0 0 50 99 1 0 0 0 0 50100 1 0 0 0 0 50101 1 0 0 0 0 51 52 1 0 0 0 0 51 53 2 0 0 0 0 52102 1 0 0 0 0 52103 1 0 0 0 0 52104 1 0 0 0 0 54105 1 0 0 0 0 54106 1 0 0 0 0 54107 1 0 0 0 0 55 56 1 0 0 0 0 55 57 2 0 0 0 0 56108 1 0 0 0 0 56109 1 0 0 0 0 56110 1 0 0 0 0 M END > 120 $$$$ 121 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 75 0 0 1 0 0 0 0 0999 V2000 0.3300 1.6480 -0.0920 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4210 2.4540 0.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 2.0650 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.7800 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 0.2290 -0.3150 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4780 -0.1930 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -1.4440 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -2.0240 0.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2660 -0.7870 -0.5500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5980 0.2070 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 2.1830 -1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -1.0820 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.8580 -0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 0.3570 2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 1.5240 3.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 3.3840 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 4.0030 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 5.4260 -2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 3.9690 -0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 5.3900 -1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -4.1650 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -5.0930 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.5970 0.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.3180 4.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 2.4820 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 0.2000 5.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -0.3380 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -6.5150 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -7.0200 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -7.4340 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -2.1610 -2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -2.5450 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -3.6580 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -1.9970 -4.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 6.2750 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 6.0380 -3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 6.5660 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 6.6070 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 7.5900 -1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 1.6330 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 2.8140 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -1.9820 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -2.5970 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -0.1890 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.3760 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -0.1220 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -0.3450 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 4.0330 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 3.4070 -2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -5.0770 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -4.7660 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 3.4030 4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 2.5540 6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 2.3310 5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -0.9910 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -6.5150 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -7.0200 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -8.0330 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -6.3660 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -7.0740 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -8.4470 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -7.4340 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -3.2420 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -4.1830 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -4.3560 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 6.3020 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 7.2890 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 5.8390 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 5.5090 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 7.0900 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 5.9500 -4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 5.5950 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 7.2130 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 7.0440 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 43 1 0 0 0 0 9 12 1 0 0 0 0 9 27 1 0 0 0 0 11 16 1 0 0 0 0 12 31 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 28 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 M END > 121 $$$$ 122 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 0.3520 0.8870 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -0.4260 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -1.3530 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.6490 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.8360 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.8430 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -3.1660 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 6.1400 -0.5990 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0230 5.7960 -1.3800 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0990 4.4240 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 3.5660 -2.0710 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4120 5.1660 -0.5850 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0060 3.7350 -0.8460 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2510 2.9050 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 1.7440 -0.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8380 2.2680 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 5.2360 0.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 1.1160 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 3.1940 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 2.1740 -2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 4.0100 -2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 6.3580 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 6.7330 -1.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 0.9070 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 1.8990 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.3240 4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 1.6990 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 2.4220 -4.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 0.2640 -3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -3.3310 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.8710 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -1.4570 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 0.1920 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.6770 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -4.2430 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -2.9520 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 6.7580 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 3.8440 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 5.4700 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 3.3620 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.1740 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 2.9770 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 2.7660 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 4.6430 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 0.4630 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 2.5990 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 4.0260 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 7.4470 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 6.0360 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 5.9910 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.6700 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 1.8370 4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 2.9060 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -0.9170 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -0.0290 5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -0.9180 4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 0.0860 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 0.0620 -4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -0.3960 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 7 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 23 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 18 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 24 2 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 27 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 M END > 122 $$$$ 123 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5100 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0430 -0.5800 0.9380 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3790 2.1110 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6100 1.2680 0.2860 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4570 -0.2320 0.4980 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7490 -0.9940 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 1.7490 -0.2770 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2000 1.0710 -1.6270 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0060 -0.4190 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -1.0230 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -0.0150 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 1.2220 -2.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 1.5580 -2.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 -0.2580 -2.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -2.5140 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -0.4930 0.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -0.6960 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -1.2030 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -0.4740 -1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 1.3940 0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 2.2040 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 1.9060 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 3.1820 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 2.7070 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 0.6940 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 3.9190 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 2.1390 1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.0250 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -0.6950 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.8600 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8500 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.3480 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -1.6640 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 2.9860 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -2.0530 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -0.8670 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 2.8310 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 1.1610 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -2.9150 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 -2.7280 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 -2.9770 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.3440 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -0.4770 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -2.1530 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 2.4880 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 -0.1610 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 0.8880 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 0.4790 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2780 3.6050 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 4.5800 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2780 4.4480 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.3070 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -0.4350 3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 1.0620 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -1.7730 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -0.4470 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -0.1940 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 29 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 10 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END > 123 $$$$ 124 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5080 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 0.7720 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 1.8920 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 3.0330 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3940 -0.2940 0.5500 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1220 -0.6730 0.7230 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1290 -2.1830 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.8810 1.4810 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8470 -1.6950 0.2110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2720 -2.6360 1.2870 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3870 -3.6550 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -2.9230 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -1.8530 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -0.9040 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -2.0770 2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -4.2690 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -1.9840 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 2.3110 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -0.1020 0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -0.0850 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 0.4920 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -0.5310 2.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.3360 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -0.1800 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.5040 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -2.5670 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.3740 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -3.9360 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -4.5340 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -3.2430 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -1.2490 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -0.8680 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 0.0920 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -4.4950 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -4.2880 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -5.0140 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 1.8910 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 3.3830 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 0.8430 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -0.2760 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 1.3270 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 19 2 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 6 10 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END > 124 $$$$ 125 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5290 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8360 -0.4730 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 1.6310 1.2810 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2230 0.1020 1.3540 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7400 -0.3110 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 2.2150 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 1.6040 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 0.4840 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 0.2320 4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 1.2140 3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -1.3600 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -0.9130 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 2.1630 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -0.2720 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 2.0410 2.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -0.5130 0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.7210 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -1.2480 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.4860 -2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8910 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8810 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.3600 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 1.6380 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.1370 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -0.1020 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -1.3750 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 1.9770 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 3.2960 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 1.3190 4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -1.7640 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.6880 2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -0.6210 5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -1.7770 4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -1.1680 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.7520 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 1.8640 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 3.2500 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -1.3980 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -0.5300 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -2.1970 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 24 1 0 0 0 0 3 6 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 17 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 M END > 125 $$$$ 126 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -1.6170 3.2420 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 2.6850 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 3.2000 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 4.3060 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 4.8400 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 4.2800 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 4.7980 -3.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 5.8430 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 6.4510 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 5.9800 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 6.2760 -5.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 1.6270 -1.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 1.1420 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -0.0250 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 -0.1010 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -1.1770 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 -2.3730 1.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9870 -3.3970 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 -3.6820 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 0.8880 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -3.0810 4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8480 -4.6100 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -2.9650 1.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -3.6300 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -4.2710 1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -3.7130 3.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 2.8340 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 2.7620 -3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 4.7340 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 7.2910 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 6.4340 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 0.8220 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 1.9370 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -0.7990 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -0.7870 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3130 -1.4940 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -2.0380 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -3.8970 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 1.7850 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 0.4430 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 1.1520 2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -2.0900 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 -3.7190 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 -3.0010 4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5160 -5.6360 2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5700 -4.3390 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -4.5250 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -4.0910 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -3.8420 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -5.3450 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 6 2 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 M END > 126 $$$$ 127 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 115118 0 0 1 0 0 0 0 0999 V2000 -2.6710 2.0430 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 1.9130 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 1.6490 5.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.5150 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 1.6460 7.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 1.9080 6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5650 0.1040 -1.6530 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5710 2.5480 -2.5960 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3350 2.5030 -1.2500 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1710 1.0900 -0.5280 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2510 1.2090 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 2.2390 1.5940 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7780 3.5920 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 3.4850 -0.2600 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0630 2.6110 -2.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2200 -0.7440 -1.8160 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7940 1.2280 -1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 0.0180 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 0.9770 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 -1.0600 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -0.4430 -0.1120 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.3720 0.5470 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.9820 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 2.7710 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -0.8900 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 0.2440 -4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 1.8550 2.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 0.9540 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 3.8300 -3.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -0.3600 1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 1.3980 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 1.0990 4.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8620 2.3370 4.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0720 1.2260 4.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 3.4580 5.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 4.2670 4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 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6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -0.7110 7.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -0.8180 5.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -1.6760 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 2.0180 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 1.5470 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 1.3080 7.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 1.5400 8.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 2.0100 7.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 0.5930 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 1.7980 -3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8370 2.2720 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 4.0130 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 4.2860 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 3.1690 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 2.7340 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -0.7780 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -2.1530 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -1.0780 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6800 -0.1180 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9930 0.6650 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 2.5000 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 1.4620 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 2.7050 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 2.0030 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4070 2.7480 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9320 3.7500 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -1.4950 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -1.5430 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.2680 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 1.0030 -4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -0.6890 -4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 0.5780 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 0.2700 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 2.5990 3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 3.6760 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 5.1500 4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 4.5760 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 2.4860 6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 3.8260 6.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2970 2.2750 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 5.2410 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 6.4720 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 5.9140 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -0.1000 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -1.6420 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.1130 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 5.9130 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 4.9600 -6.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2850 5.4370 -5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 7.7220 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 7.5980 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 7.1150 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4130 -1.7140 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6570 -2.8560 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2200 -2.8970 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -1.4900 7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -1.1020 8.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 0.1380 8.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 62 1 0 0 0 0 4 5 2 0 0 0 0 4 63 1 0 0 0 0 5 6 1 0 0 0 0 5 64 1 0 0 0 0 6 65 1 0 0 0 0 7 10 1 0 0 0 0 7 16 1 0 0 0 0 7 53 1 0 0 0 0 7 66 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 29 1 0 0 0 0 8 67 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 22 2 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 68 1 0 0 0 0 13 14 1 0 0 0 0 13 69 1 0 0 0 0 13 70 1 0 0 0 0 14 48 1 0 0 0 0 14 71 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 15 72 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 60 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 73 1 0 0 0 0 20 74 1 0 0 0 0 21 30 1 0 0 0 0 21 75 1 0 0 0 0 22 76 1 0 0 0 0 22 77 1 0 0 0 0 23 78 1 0 0 0 0 23 79 1 0 0 0 0 23 80 1 0 0 0 0 24 81 1 0 0 0 0 24 82 1 0 0 0 0 24 83 1 0 0 0 0 25 84 1 0 0 0 0 25 85 1 0 0 0 0 25 86 1 0 0 0 0 26 87 1 0 0 0 0 26 88 1 0 0 0 0 26 89 1 0 0 0 0 27 31 1 0 0 0 0 29 45 1 0 0 0 0 30 42 1 0 0 0 0 31 32 1 0 0 0 0 31 34 2 0 0 0 0 32 33 1 0 0 0 0 32 49 1 0 0 0 0 32 90 1 0 0 0 0 33 35 1 0 0 0 0 33 91 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 36 92 1 0 0 0 0 36 93 1 0 0 0 0 36 94 1 0 0 0 0 37 95 1 0 0 0 0 37 96 1 0 0 0 0 37 97 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 98 1 0 0 0 0 40 99 1 0 0 0 0 40100 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 44101 1 0 0 0 0 44102 1 0 0 0 0 44103 1 0 0 0 0 45 46 2 0 0 0 0 45 47 1 0 0 0 0 47104 1 0 0 0 0 47105 1 0 0 0 0 47106 1 0 0 0 0 48 50 1 0 0 0 0 49 57 1 0 0 0 0 50 51 1 0 0 0 0 50 52 2 0 0 0 0 51107 1 0 0 0 0 51108 1 0 0 0 0 51109 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 2 0 0 0 0 55110 1 0 0 0 0 55111 1 0 0 0 0 55112 1 0 0 0 0 57 58 1 0 0 0 0 57 59 2 0 0 0 0 58113 1 0 0 0 0 58114 1 0 0 0 0 58115 1 0 0 0 0 M END > 127 $$$$ 128 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 76 80 0 0 1 0 0 0 0 0999 V2000 0.0490 1.5400 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 1.8490 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 0.8800 -0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -0.1090 0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1750 0.3910 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 2.3960 -0.3760 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7900 0.6690 -6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 0.6640 -6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 1.1040 -4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 1.2950 -5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 2.0670 -4.3410 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.5930 1.3800 -3.7280 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0460 2.1220 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 2.0500 -1.4230 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2640 2.0890 -3.3080 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6470 2.6730 -1.9620 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8840 2.8520 -2.7810 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9460 2.5950 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 1.9960 -1.5450 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5000 2.3540 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 2.3550 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 2.0550 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 2.8340 -1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0120 0.3030 -6.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6740 2.3030 -4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5760 -0.0660 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2330 0.3810 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 3.4710 -4.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 0.9990 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 4.2010 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 2.5460 -3.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 0.5020 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -1.3780 -0.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6930 0.6640 -1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 3.5380 -3.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 4.6260 -4.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 3.2950 -4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 0.1700 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2070 0.8720 0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -1.2600 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -0.1890 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.0920 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 3.4530 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 0.1480 -7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 1.2620 -5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 3.1590 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9380 1.6390 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 2.6000 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 3.9070 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 1.8560 -4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 3.5240 -4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 2.5430 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 1.0070 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 2.6980 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 2.0510 -5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1080 2.5560 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1120 3.1560 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9460 -0.9510 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 0.2100 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -0.2820 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 3.4080 -5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 4.0290 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 3.9820 -5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 4.5810 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 4.6380 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 4.4710 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 0.2920 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.0700 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 0.2200 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -1.7370 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 2.5020 -5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 4.2090 -5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 2.9980 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -1.4110 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 -1.4790 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -1.9260 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 23 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 41 1 0 0 0 0 5 42 1 0 0 0 0 6 19 1 0 0 0 0 6 22 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 24 2 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 29 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 35 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 34 38 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 M END > 128 $$$$ 129 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 95 98 0 0 1 0 0 0 0 0999 V2000 -0.5260 0.8320 0.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3740 -0.6610 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 0.1630 0.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 4.5490 -1.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4510 3.1360 -1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.6060 -2.9240 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1820 3.6960 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 4.2500 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 4.8080 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.8280 -1.2970 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7080 1.8710 -1.0700 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1390 1.3270 1.3370 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6110 1.6800 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 2.5660 -0.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1600 1.3540 -2.4270 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5140 4.0530 -2.3540 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6770 2.5350 -2.6000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1280 5.7190 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 4.6540 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 4.9960 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 5.0140 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 5.2890 -0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 4.8310 -4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 3.2720 -4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 0.2460 -2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.7080 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -1.8870 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 0.3790 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 2.8300 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 3.9330 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 4.2700 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 4.6550 0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 2.4970 1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 2.6480 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 3.7780 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 2.1310 -3.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.2900 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 0.6580 -4.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 1.0400 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.6220 -4.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 4.8120 -3.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 6.0690 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 6.9140 -4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 6.5220 -2.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 2.2810 -2.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 2.2350 -4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 2.3990 -4.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 1.9800 -4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 2.8750 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.8790 3.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -1.3300 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -1.0840 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 5.3040 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 3.1620 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 2.4480 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 0.5330 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 0.7850 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 2.2520 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 3.5050 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 1.1120 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 4.3360 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 2.0850 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 6.1050 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 6.5510 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 5.1580 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 4.0020 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 5.3980 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 5.6550 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 4.5900 -5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 5.7730 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 4.9220 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 2.2190 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 3.8740 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 3.4180 -5.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -1.7920 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -2.8070 -3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -1.9150 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -0.1340 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 0.3920 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -0.1430 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6930 3.5100 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 4.3040 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 5.2420 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 4.6260 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 3.4480 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 4.0760 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.2960 -4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -0.3190 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 0.5380 -5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 6.7730 -4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 7.9630 -3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 6.6160 -5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5380 2.9300 -4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 1.4650 -5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 1.3610 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 51 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 19 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 54 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 17 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 14 29 1 0 0 0 0 14 59 1 0 0 0 0 15 25 1 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 61 1 0 0 0 0 17 45 1 0 0 0 0 17 62 1 0 0 0 0 18 63 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 66 1 0 0 0 0 21 67 1 0 0 0 0 21 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 72 1 0 0 0 0 24 73 1 0 0 0 0 24 74 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 40 2 0 0 0 0 27 75 1 0 0 0 0 27 76 1 0 0 0 0 27 77 1 0 0 0 0 28 78 1 0 0 0 0 28 79 1 0 0 0 0 28 80 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 31 83 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 50 2 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 87 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 2 0 0 0 0 43 90 1 0 0 0 0 43 91 1 0 0 0 0 43 92 1 0 0 0 0 45 46 1 0 0 0 0 46 47 2 0 0 0 0 46 48 1 0 0 0 0 48 93 1 0 0 0 0 48 94 1 0 0 0 0 48 95 1 0 0 0 0 M END > 129 $$$$ 130 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 79 83 0 0 1 0 0 0 0 0999 V2000 0.9140 2.0840 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 0.7410 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 0.2500 -1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 1.1000 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 2.4460 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 2.9500 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 5.6200 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 6.7390 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 7.8450 3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 7.8260 3.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 6.7140 3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 5.6140 4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 8.2940 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 9.8100 3.2870 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5260 10.1600 1.9060 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8170 7.7760 2.1400 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1390 8.4330 0.7860 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2920 9.9400 1.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3590 10.7630 -0.2610 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2060 10.4200 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 8.9170 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 8.1780 -0.1510 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3860 7.7640 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 10.3620 1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 10.6330 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 12.1500 0.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 11.5230 1.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 10.5480 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 12.0470 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 10.0110 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 11.7130 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 10.7700 2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 13.1010 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 7.8330 2.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 6.7520 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 5.7870 3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 6.7760 -0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 6.2930 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 4.8680 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 4.3850 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 7.0430 -0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 2.4670 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 0.0710 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.8030 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 0.7090 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 3.1080 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 4.7620 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 8.7140 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 8.6820 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 6.7050 4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 4.7490 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 7.9730 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 7.8120 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 10.1620 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 9.4740 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 6.6980 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 10.9500 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 10.7460 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 8.5800 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 8.7010 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 8.5380 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 8.0190 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 8.1120 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 6.6820 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 10.8240 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 11.3570 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 9.6250 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 12.7600 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 12.1800 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 12.5550 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 12.4680 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 8.9240 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 10.4310 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 10.2930 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 13.8150 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 13.1370 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2230 13.3560 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 4.2020 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 5.0510 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 10 11 2 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 54 1 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 37 1 0 0 0 0 22 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 24 28 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 68 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 41 2 0 0 0 0 39 40 2 0 0 0 0 39 78 1 0 0 0 0 40 79 1 0 0 0 0 M END > 130 $$$$ 131 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 94 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.9380 -0.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2720 0.4220 -0.3130 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2910 -0.1440 1.0310 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4030 2.3330 -0.1220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1430 1.5240 0.9610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7970 0.0480 0.7590 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6380 -0.9180 1.5600 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1310 -0.6540 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 0.8100 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 1.7150 0.7230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0000 3.0780 0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 2.0690 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 3.7440 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 2.4900 0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -0.2240 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.2120 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -1.6520 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 0.5720 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -1.5410 1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.7970 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -0.8850 2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -3.2210 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -0.9400 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 3.5810 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 4.9690 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 2.8810 -0.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 5.4720 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 6.8690 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 7.3940 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 8.7040 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 9.4970 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 8.9840 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 7.6790 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 3.7490 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 4.3870 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 4.3720 -0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 5.8130 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 6.4600 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 4.6400 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 6.0850 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 4.2600 -1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 7.0170 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 8.3650 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 8.7940 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 7.8770 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 6.5260 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 2.3960 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 0.1360 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.4370 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 2.2190 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.9320 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -1.2940 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -0.8900 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 1.0470 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 0.9800 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 1.4650 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.8620 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.5900 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 3.1460 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -1.6460 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.0890 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.2420 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 1.5920 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 0.0910 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 0.5920 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -3.8990 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -3.4140 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -3.3800 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.1000 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.7470 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 0.0120 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 5.5900 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 4.8500 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 6.7760 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1860 9.1110 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 10.5220 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 9.6100 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 7.2800 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 3.8050 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 4.4140 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 6.3950 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 5.7850 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 7.4760 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 5.8780 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 6.4880 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 6.6830 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 9.0860 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 9.8510 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 8.2190 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 5.8110 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 48 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 52 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 54 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 56 1 0 0 0 0 11 24 1 0 0 0 0 12 57 1 0 0 0 0 12 58 1 0 0 0 0 12 59 1 0 0 0 0 13 39 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 60 1 0 0 0 0 17 61 1 0 0 0 0 17 62 1 0 0 0 0 18 63 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 25 72 1 0 0 0 0 27 28 1 0 0 0 0 27 73 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 74 1 0 0 0 0 30 31 1 0 0 0 0 30 75 1 0 0 0 0 31 32 2 0 0 0 0 31 76 1 0 0 0 0 32 33 1 0 0 0 0 32 77 1 0 0 0 0 33 78 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 37 38 1 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 42 1 0 0 0 0 40 46 2 0 0 0 0 42 43 2 0 0 0 0 42 86 1 0 0 0 0 43 44 1 0 0 0 0 43 87 1 0 0 0 0 44 45 2 0 0 0 0 44 88 1 0 0 0 0 45 46 1 0 0 0 0 45 89 1 0 0 0 0 46 90 1 0 0 0 0 M END > 131 $$$$ 132 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 93 97 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.9380 -0.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2720 0.4220 -0.3130 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2910 -0.1440 1.0310 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4030 2.3330 -0.1220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1430 1.5240 0.9610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7970 0.0480 0.7590 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6380 -0.9180 1.5600 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1310 -0.6540 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 0.8100 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 1.7150 0.7230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0000 3.0780 0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 2.0690 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 3.7440 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 2.4900 0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -0.2240 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.2120 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -1.6520 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 0.5720 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -1.5410 1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.7970 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -0.8850 2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -3.2210 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -0.9400 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 3.5810 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 4.9690 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 2.8810 -0.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 5.4720 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 6.8690 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 7.3940 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 8.7040 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 9.4970 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 8.9840 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 7.6790 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 3.7490 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 4.3870 1.8420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0340 4.3710 -0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 5.8130 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 6.5030 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 4.6400 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 6.0850 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 4.2600 -1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 7.0170 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 8.3650 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 8.7940 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 7.8770 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 6.5260 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 3.5700 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 2.3960 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 0.1360 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.4370 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 2.2190 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.9320 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -1.2940 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -0.8900 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 1.0470 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 0.9800 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 1.4650 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.8620 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.5900 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 3.1460 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -1.6460 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.0890 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.2420 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 1.5920 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 0.0910 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 0.5920 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -3.7490 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -3.2300 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -3.7150 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.1000 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.7470 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 0.0120 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 5.5900 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 4.8500 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 6.7760 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1860 9.1110 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 10.5220 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 9.6100 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 7.2800 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 4.4140 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 6.3690 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 5.7810 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 5.9460 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 6.5350 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 7.5180 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 6.6830 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 9.0860 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 9.8510 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 8.2190 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 5.8110 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 4.0310 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 3.5420 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 2.5540 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 49 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 57 1 0 0 0 0 11 24 1 0 0 0 0 12 58 1 0 0 0 0 12 59 1 0 0 0 0 12 60 1 0 0 0 0 13 39 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 61 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 18 66 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 23 72 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 25 73 1 0 0 0 0 27 28 1 0 0 0 0 27 74 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 75 1 0 0 0 0 30 31 1 0 0 0 0 30 76 1 0 0 0 0 31 32 2 0 0 0 0 31 77 1 0 0 0 0 32 33 1 0 0 0 0 32 78 1 0 0 0 0 33 79 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 1 0 0 0 0 35 47 1 0 0 0 0 35 80 1 0 0 0 0 37 38 1 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 42 1 0 0 0 0 40 46 2 0 0 0 0 42 43 2 0 0 0 0 42 86 1 0 0 0 0 43 44 1 0 0 0 0 43 87 1 0 0 0 0 44 45 2 0 0 0 0 44 88 1 0 0 0 0 45 46 1 0 0 0 0 45 89 1 0 0 0 0 46 90 1 0 0 0 0 47 91 1 0 0 0 0 47 92 1 0 0 0 0 47 93 1 0 0 0 0 M END > 132 $$$$ 133 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 77 0 0 1 0 0 0 0 0999 V2000 -1.5520 0.9280 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.3330 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.1230 0.9560 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4030 1.8170 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 1.2620 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 2.0750 1.2250 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1660 2.6060 -0.1650 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1970 -0.5400 -0.3180 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0360 0.0240 -2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.9850 -3.9340 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4640 1.6390 -3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 2.4070 -2.5200 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1300 0.5870 -1.3600 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3480 1.5260 -1.2600 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 3.1120 -2.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.9560 -3.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -1.7690 -0.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 0.7660 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 3.4220 -0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 1.3020 1.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 1.1970 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 1.1500 2.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 3.2060 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -1.0240 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.5140 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -2.4600 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -0.9940 2.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.8820 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -2.8160 -0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -1.2300 -3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -4.2140 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 4.7340 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 5.1850 0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 5.6230 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 6.9830 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 7.8080 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 7.2910 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 5.9440 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 5.1090 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -1.2210 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -0.3840 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 2.9260 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 3.2570 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -0.7990 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 0.4270 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 0.8740 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 2.3210 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 3.1380 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 3.6950 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 2.5980 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 1.4750 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 0.1300 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 0.1490 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 0.9660 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 3.9130 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 3.2310 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 3.4800 2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -0.5360 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.1500 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 0.5090 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -2.9330 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -3.0210 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.4500 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -1.5670 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -1.9980 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -1.5040 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -4.3930 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -5.0040 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -4.2080 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 7.3880 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 8.8600 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 7.9410 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 5.5470 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 4.0580 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 2 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 42 1 0 0 0 0 7 14 1 0 0 0 0 7 19 1 0 0 0 0 7 43 1 0 0 0 0 8 13 1 0 0 0 0 8 17 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 30 2 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 18 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 17 28 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 32 1 0 0 0 0 20 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 70 1 0 0 0 0 36 37 1 0 0 0 0 36 71 1 0 0 0 0 37 38 2 0 0 0 0 37 72 1 0 0 0 0 38 39 1 0 0 0 0 38 73 1 0 0 0 0 39 74 1 0 0 0 0 M END > 133 $$$$ 134 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.7600 1.8010 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 0.3490 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -0.5570 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 2.3380 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 1.5280 -0.0900 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9270 0.0980 -0.5180 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2120 -0.7230 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -0.1520 -1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 2.1580 -1.1540 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3850 1.3270 -1.4130 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0220 1.8920 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 3.1540 -2.1030 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5340 4.0900 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 3.5780 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 2.2220 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 0.1650 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 3.7830 -2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 2.6240 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 1.6010 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 5.1660 -2.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -0.1250 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 2.6150 0.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 2.5160 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 3.3390 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.7680 2.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 1.5630 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -0.8370 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -1.8950 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 3.4150 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -0.7050 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -1.7660 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -0.6870 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -0.3090 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 1.1990 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 2.1540 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 4.2300 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 3.5930 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 4.0890 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2000 4.6530 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 3.0540 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 3.0300 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 1.0350 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 3.9480 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 2.6770 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 3.9870 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 1.2640 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 0.8750 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 2.5740 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -1.4730 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -1.3420 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 0.1030 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.7170 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.5790 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -2.3350 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 21 2 0 0 0 0 3 6 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END > 134 $$$$ 135 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2970 7.7300 6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 7.2850 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 6.0720 5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0970 5.2980 5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 5.5920 3.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 4.7670 4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 4.2870 2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 3.4480 2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 3.0980 1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7710 2.3520 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 2.1120 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0240 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -0.6420 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 3.5390 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1130 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2320 6.9590 7.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6340 5.7380 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5540 4.9780 7.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 3.7370 7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 7.3940 8.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 2.2530 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 4.5760 1.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 2.3460 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 1.5000 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 3.1080 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7620 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 8.6760 7.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 7.8870 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4070 4.3510 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3110 4.9750 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3210 6.4510 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 5.3850 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 3.9090 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 4.0070 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 2.5310 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 4.0130 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.9500 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.3950 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 3.0690 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 1.5140 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.8300 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 3.8710 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 3.8620 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 3.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6580 3.2320 7.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3430 3.9260 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0350 3.1070 7.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5590 7.9260 8.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 2.0380 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 1.2840 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 0.5650 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 17 2 0 0 0 0 3 32 1 0 0 0 0 4 16 2 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 27 2 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END > 135 $$$$ 136 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 72 0 0 1 0 0 0 0 0999 V2000 0.9670 -1.0440 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.9910 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -0.3660 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 0.2020 -3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 0.1460 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -0.4750 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.6500 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -1.5500 -1.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -0.7120 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -1.6680 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -0.3110 -4.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.3470 -5.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 0.7640 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 2.2250 -1.5320 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5510 2.2830 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 2.8870 -1.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3700 3.6450 0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 2.0630 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 2.7780 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 3.6780 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2830 4.3380 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 4.0940 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7710 3.1890 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5550 2.5290 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3340 4.7410 -1.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4550 4.1080 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6380 5.2240 0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 5.4260 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6060 2.9470 -3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1630 2.0040 -4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 2.9600 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 3.8380 -3.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 4.0110 -5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 4.9080 -5.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 3.4490 -5.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 0.6870 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -0.5150 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.3600 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 0.1430 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -1.2790 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -2.1930 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.6450 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -2.1800 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 0.3200 -5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 1.3840 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.1600 -5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 0.2170 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 0.7190 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 2.7510 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 1.7340 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 1.8340 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 3.8940 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 3.7580 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 1.9360 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 1.0860 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4000 3.8670 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2680 1.8250 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2580 3.9840 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6200 3.1320 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3420 4.7270 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 5.7960 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 4.4810 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 6.1540 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 1.0360 -3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 2.3520 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9200 1.9040 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 3.3510 -3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 1.9630 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 5.3240 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 5.7180 -6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 4.3300 -6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 37 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 49 1 0 0 0 0 15 17 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 34 71 1 0 0 0 0 M END > 136 $$$$ 137 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 0.2700 1.5180 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 0.0210 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.7800 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 1.8460 0.3700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4060 1.1120 1.5490 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1570 -0.3880 1.4360 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7600 -1.0820 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -0.8650 2.6380 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9230 1.3580 1.5250 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6170 0.6280 2.6760 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1440 0.7580 2.5570 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1880 2.8670 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.6550 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.2660 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -0.8670 0.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 1.6910 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 0.6360 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 3.0480 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 2.0880 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8410 2.5810 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 3.8180 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 4.0960 1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 1.4700 -0.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 2.4020 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 3.4960 -1.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 2.0840 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -1.5410 3.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.4630 4.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1020 0.7190 4.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6320 0.5930 5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 -2.8200 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -3.5850 4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 -3.3570 2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 1.0480 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 0.9960 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 2.0540 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8480 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -0.2040 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -0.2840 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 2.9240 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -0.7000 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.1580 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -1.3040 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -0.0410 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.3990 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 3.2540 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -1.1540 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -1.1200 3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 0.3990 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3940 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.8840 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.5670 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -1.8250 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.6550 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 1.1070 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 2.7260 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7700 2.0690 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 4.4750 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 1.2470 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 2.9560 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 1.8190 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 1.3840 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 -0.3780 5.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 0.6780 5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -3.6240 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -4.5990 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -3.0870 5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 17 1 0 0 0 0 11 19 1 0 0 0 0 11 44 1 0 0 0 0 12 18 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 28 2 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 31 1 0 0 0 0 29 30 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 M END > 137 $$$$ 138 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 0.2780 1.5310 0.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0860 0.0320 0.0890 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7750 -0.7830 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 1.8890 0.3370 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4320 1.1430 1.4860 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2200 -0.3560 1.3580 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9070 -1.0440 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.9430 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 1.4160 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 0.4420 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 0.7300 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 2.6790 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.7230 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.2560 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -0.7930 0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 1.7000 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -0.3260 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 2.9880 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 1.9960 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 2.6290 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7240 3.8880 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 4.1000 0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 1.5730 -0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.3740 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -0.3440 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.7520 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 0.0090 -2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 2.5380 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 3.6120 -1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 2.2820 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 2.2330 -0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 2.5820 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 2.3120 0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 3.3110 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 1.8550 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -0.1880 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 2.9680 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -0.5940 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -2.1030 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -1.1920 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -1.6640 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 3.4370 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -1.2430 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.2020 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.3180 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.3350 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.8840 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.5860 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -1.7490 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 1.6580 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 1.1040 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 2.7340 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 -0.8730 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 0.1480 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -1.0170 2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 2.1750 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 4.6240 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.7850 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.6640 -4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.1030 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 1.8800 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 3.2170 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 1.5650 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 3.4650 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 2.7180 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 4.2760 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 17 1 0 0 0 0 11 19 2 0 0 0 0 12 18 2 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 138 $$$$ 139 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4960 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -0.5350 -0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4840 0.1150 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 1.6080 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 2.2370 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 3.7400 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 2.2610 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -2.0530 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -2.5680 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -2.4040 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -2.6740 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -4.0130 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -4.6450 -0.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.7270 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 1.9960 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -0.3690 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.3690 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -0.2870 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -0.0900 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -0.2720 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 4.0900 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 4.1750 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 4.0420 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -2.1020 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -3.6500 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -2.3180 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -2.0370 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -3.4860 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -1.9380 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.9970 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -5.4090 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -5.2920 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 6 7 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 M END > 139 $$$$ 140 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.0420 1.8590 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.3920 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 1.5820 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 0.2380 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.2910 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.5190 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -0.0600 -0.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5490 2.1040 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 2.8440 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 3.5510 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -1.4230 -0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -1.8720 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -0.0550 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -1.1820 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -3.2770 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -1.1500 -1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 2.9440 1.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 2.4900 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 3.4390 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -0.3960 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.3370 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 0.5420 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 4.5480 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 3.6340 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 2.9830 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 0.8770 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -2.1140 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -1.1790 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -3.7720 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -3.8300 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -3.2450 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 15 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 M END > 140 $$$$ 141 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 106113 0 0 1 0 0 0 0 0999 V2000 0.6450 -0.2120 -0.4610 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7660 -1.7270 -0.2770 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5270 -2.0140 1.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8930 -1.3250 0.9660 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7090 0.0780 0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 0.4080 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -1.5410 2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0690 -1.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -2.3060 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -3.4240 1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 0.4110 2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -1.0330 2.2090 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7870 -1.9040 3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 0.9870 2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 0.0780 3.5220 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2260 -1.3900 3.0820 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1080 -2.1690 4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5300 -1.6300 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 0.6620 4.1880 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6650 -0.2300 4.5090 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0720 2.5860 3.5960 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6730 2.1750 4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0560 1.8520 4.4950 C 0 0 1 0 0 0 0 0 0 0 0 0 10.9690 0.3660 4.0520 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2440 -0.2760 4.6080 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5270 2.1340 4.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 13.2240 0.8880 4.8040 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4960 0.7330 4.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5490 2.0360 6.1810 C 0 0 1 0 0 0 0 0 0 0 0 0 13.9230 3.4060 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0800 3.4390 4.6780 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4550 1.0830 6.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9370 4.0120 3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3800 1.5840 4.9640 C 0 0 1 0 0 0 0 0 0 0 0 0 15.1260 2.0180 7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6080 0.7950 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4190 0.3560 4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4770 1.6800 6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1880 -0.3580 6.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6970 2.0250 5.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2380 4.0210 3.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9550 4.7820 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 6.2800 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5810 4.2670 1.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7740 -1.2180 3.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 0.3070 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 0.3180 5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6170 -1.4720 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -1.8270 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -3.3540 2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 -0.3340 5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6860 2.4470 4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6620 2.0940 3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.2090 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.1550 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.6300 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -1.7380 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 0.0170 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 1.4920 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 1.0120 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -2.1570 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -3.6780 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 1.0110 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 0.4380 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -1.0610 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.0180 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 1.9930 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7560 -2.0120 5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 -3.2310 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2210 -2.3010 4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7870 -1.5920 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 2.2990 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 2.5500 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 2.6460 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0380 -0.7630 5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2940 3.6620 6.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7180 4.1470 5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2470 4.1220 4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2980 4.2670 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4510 4.9070 3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6710 3.2690 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7400 1.2350 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2940 -0.2060 4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8000 -0.2750 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8990 1.9930 7.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3520 1.1180 6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7970 2.5590 5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6320 -0.9650 5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 1.6140 6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4270 1.4990 6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7040 3.0850 6.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1140 6.5610 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 6.7530 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9190 6.6080 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6060 -1.6240 3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1090 0.7210 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8800 0.8880 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1370 -0.7290 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 1.1480 5.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -0.5550 5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -2.1850 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 -2.4480 5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -0.7940 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 -3.4070 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -3.9730 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -3.7160 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 6 58 1 0 0 0 0 6 59 1 0 0 0 0 7 12 1 0 0 0 0 8 60 1 0 0 0 0 9 61 1 0 0 0 0 10 62 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 63 1 0 0 0 0 11 64 1 0 0 0 0 12 13 1 0 0 0 0 12 65 1 0 0 0 0 13 16 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 66 1 0 0 0 0 14 67 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 68 1 0 0 0 0 17 69 1 0 0 0 0 18 20 1 0 0 0 0 18 70 1 0 0 0 0 18 71 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 47 1 0 0 0 0 20 24 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 21 72 1 0 0 0 0 22 73 1 0 0 0 0 22 74 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 45 1 0 0 0 0 25 75 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 34 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 29 34 1 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 33 1 0 0 0 0 31 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 34 36 1 0 0 0 0 34 52 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 37 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 38 85 1 0 0 0 0 38 86 1 0 0 0 0 38 87 1 0 0 0 0 39 88 1 0 0 0 0 40 89 1 0 0 0 0 40 90 1 0 0 0 0 40 91 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 2 0 0 0 0 43 92 1 0 0 0 0 43 93 1 0 0 0 0 43 94 1 0 0 0 0 45 95 1 0 0 0 0 46 96 1 0 0 0 0 46 97 1 0 0 0 0 46 98 1 0 0 0 0 47 99 1 0 0 0 0 47100 1 0 0 0 0 49101 1 0 0 0 0 49102 1 0 0 0 0 49103 1 0 0 0 0 50104 1 0 0 0 0 50105 1 0 0 0 0 50106 1 0 0 0 0 M END > 141 $$$$ ATCMD MOE2008 3D 47 49 0 0 1 0 0 0 0 0999 V2000 -4.4060 0.3100 0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -0.7930 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -0.5440 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7900 0.3000 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 -0.3490 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 -1.4310 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -1.8350 -0.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -1.7970 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.8550 0.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -1.3320 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -0.3060 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -2.2050 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.2480 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -2.9900 0.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -1.7990 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -1.9090 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -2.3010 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 -1.5180 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7070 -1.6080 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 -1.0130 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1590 -0.7100 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -0.9000 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -0.5080 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -1.2910 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -1.1990 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 0.3720 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.5210 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 0.5410 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 0.2130 0.2210 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4030 1.4200 1.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1120 1.8130 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.5770 0.7420 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0390 1.2570 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 2.1900 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.6270 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 1.6020 -1.0950 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4110 2.1320 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 2.4270 -0.0270 N 0 0 3 0 0 0 0 0 0 0 0 0 -3.2130 3.2000 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 3.9370 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 3.7650 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 2.5970 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 1.0910 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 2.0050 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 0.3540 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -0.7350 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 0.7410 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 26 36 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 38 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 43 1 0 0 0 0 32 47 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M END > 142 $$$$ 143 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 0.2180 0.7100 0.0570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3370 -0.7850 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.4400 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.3560 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.6630 0.9370 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7740 -0.7710 0.4680 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5150 -0.7710 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -0.0980 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 1.4280 1.0960 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6520 0.3410 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 1.1640 3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 1.7270 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 0.8560 2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 1.5320 5.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 1.2940 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 -0.0800 4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 -1.0100 4.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 0.4100 5.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 2.9060 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 0.6340 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -1.5320 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -2.9460 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.1110 -1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 2.3470 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 1.2110 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 1.6230 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 0.9710 0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.0460 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -1.3590 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 1.2260 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 2.4180 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -1.7990 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -0.2280 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -0.6730 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -0.0360 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -0.0170 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 2.7440 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 1.7400 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 0.8440 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -0.1600 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 2.3640 5.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 1.8240 5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 0.6740 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 -1.2540 5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 3.0020 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 3.4540 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 3.3140 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -2.5940 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -1.3930 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -1.1530 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -3.2730 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -3.3390 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -3.3170 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 2.2290 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 3.3320 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 0.9050 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 1.6480 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 2.6130 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 15 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 M END > 143 $$$$ 144 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 -0.1270 0.8170 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.6810 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.4990 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -0.8210 -0.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2800 1.3640 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 1.2040 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 0.4960 1.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6160 -1.4740 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 -1.0160 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 2.2320 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 2.8750 -0.4100 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5850 2.5380 0.9670 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5530 1.0060 1.1780 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2940 0.8980 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 1.8350 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 2.8710 1.2340 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1800 4.2880 1.7990 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8780 0.6830 -0.0860 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7290 3.2550 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -1.2190 -2.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 4.5420 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 5.9100 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 6.1600 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8060 7.2140 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 0.2850 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1860 8.0720 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1900 7.5260 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -1.7360 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.8720 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5080 7.9580 0.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2620 8.9840 2.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 2.4880 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 5.3020 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 3.2590 -2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 4.2270 -2.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 2.9160 -3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 1.0640 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6470 2.7740 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.2610 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 1.0600 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.9800 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 1.1710 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 2.4400 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 0.6960 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -1.1790 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -2.5590 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -1.2870 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -1.5300 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 2.6670 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 3.9720 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 1.2280 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -0.1300 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 2.3450 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3640 1.2670 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 4.3930 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 2.9160 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 3.0250 3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 4.3310 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9370 3.7670 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 4.5240 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 6.6860 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 5.9280 3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6300 5.4850 4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 0.4610 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 0.6660 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 -0.7850 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9280 7.0150 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3600 8.6020 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2830 7.1890 4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -2.3710 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -2.2260 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -0.7810 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -2.7300 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -3.4960 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.3590 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8820 9.5260 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 5.2030 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 6.3110 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 5.1150 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 2.0180 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 2.7410 -4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 3.7430 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 0.5400 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.1400 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.7820 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 20 2 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 8 1 0 0 0 0 4 18 1 0 0 0 0 4 41 1 0 0 0 0 5 18 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 17 55 1 0 0 0 0 18 37 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 63 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 30 2 0 0 0 0 26 31 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 31 76 1 0 0 0 0 32 34 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 M END > 144 $$$$ 145 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 1.4070 3.7420 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.2740 3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 1.2990 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.8700 3.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6590 4.1900 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 3.7590 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 2.9180 2.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8380 1.0450 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 1.4470 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 4.8160 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 5.3320 0.9680 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4590 4.9120 1.6880 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4560 3.3840 1.7750 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8770 3.0840 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7390 4.2120 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7820 5.1480 0.9340 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2410 6.6030 1.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8510 3.3410 3.3310 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5330 5.5620 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 1.8800 2.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 6.6650 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2320 8.0960 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7360 8.1570 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3360 8.9550 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 2.7730 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5350 9.6910 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8350 9.1030 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 0.9720 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -0.0040 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4730 9.2960 -1.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8690 10.8040 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 6.7900 0.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6510 7.4490 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 7.3330 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 6.6210 -0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 8.8300 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 3.6060 4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7150 4.8860 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 4.3070 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 3.9130 4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.7900 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 4.0650 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 5.2410 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 3.0060 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 1.2270 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -0.0170 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 1.2860 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 0.8230 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 5.3680 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 4.9570 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9150 3.0750 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2070 2.1230 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2350 4.7520 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4830 3.8060 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8990 6.9890 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6800 5.2400 3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 5.2590 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 6.6460 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 5.9930 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1060 6.3630 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8110 8.7680 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8950 8.3980 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3280 7.5540 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 3.0970 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 3.1020 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 1.6860 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2820 8.3520 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1060 10.0980 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2030 8.9670 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 0.4330 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 0.3520 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 1.8960 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 0.2080 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -0.7360 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.4010 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3550 11.2540 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5770 7.2720 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8340 8.5050 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 7.1740 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 9.3010 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 9.1620 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 9.1110 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 2.9730 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 4.6540 4.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 3.3800 5.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 20 2 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 8 1 0 0 0 0 4 18 1 0 0 0 0 4 41 1 0 0 0 0 5 18 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 17 55 1 0 0 0 0 18 37 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 63 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 30 2 0 0 0 0 26 31 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 31 76 1 0 0 0 0 32 34 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 M END > 145 $$$$ 146 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.6580 1.8510 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 0.3490 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -0.0110 -2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 2.0510 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 1.4830 -1.2740 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0830 0.5030 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 0.0510 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 0.6130 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 2.5080 -1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 2.0560 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 2.9380 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 4.2780 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 4.7250 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 3.8360 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -0.0580 -3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 5.2500 -4.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1210 6.3400 -4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 5.8900 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 6.0390 -2.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -1.5320 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 0.6120 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -0.8680 -4.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 0.6630 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 2.4940 -4.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 4.2860 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 4.4340 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 4.1700 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 4.9290 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 7.2080 -5.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 8.2220 -6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 9.1650 -7.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 8.3800 -6.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 2.4050 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 2.1970 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.2240 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 0.1360 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 3.1180 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 1.5640 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 4.7210 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 5.8780 -5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 6.9260 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 6.5920 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 6.4190 -2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 5.1130 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 6.5740 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -1.9270 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -1.7860 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -1.9690 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 1.6950 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 0.3560 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 0.2270 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -1.1120 -4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.1170 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 0.2070 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.3160 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 2.5240 -5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 4.0790 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 5.4770 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 5.5880 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 8.6050 -7.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 9.9180 -7.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 9.6530 -6.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 39 1 0 0 0 0 17 29 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END > 146 $$$$ 147 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 2.7540 -5.0870 3.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -4.8430 4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -4.5720 2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -4.5550 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -5.0840 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -4.8220 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.8180 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -5.0690 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -5.3300 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -5.3390 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -4.8560 5.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -5.5950 3.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -6.9600 4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -5.5780 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -5.5540 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -5.8480 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -6.6880 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 -7.1060 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -6.2190 -1.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4260 -6.7140 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 -7.1840 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2950 -7.1140 -4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -7.2350 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -4.8500 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -3.8790 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -4.1620 -3.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -2.4340 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3780 -7.7970 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -4.3800 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -4.3490 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -4.6160 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -5.0660 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -7.3590 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -7.0240 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -7.5400 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -4.5690 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -6.3080 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -5.3680 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 -8.1460 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -7.0000 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -6.2560 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9690 -6.6810 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -7.9690 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 -7.1280 -4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7150 -6.1920 -4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -8.1100 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -7.5170 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -6.4720 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -2.3760 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -1.9070 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1190 -1.9740 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1310 -7.0240 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4840 -8.5650 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5140 -8.2440 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 6 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END > 147 $$$$ 148 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5300 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4730 1.8240 0.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9240 1.6180 1.6760 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4110 -0.3170 2.2290 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8700 0.2060 2.2060 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2080 -0.9400 0.8570 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2510 0.0340 -0.2370 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7560 -0.2560 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -1.6960 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -2.0730 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 2.1740 -1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 0.9680 -0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 2.0780 1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -1.2880 3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 2.2010 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 0.0410 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -1.0100 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 0.7040 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -1.5410 5.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -3.4530 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.2630 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.3450 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 3.3690 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 1.4430 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 0.6100 -1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 2.5380 -0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 4.0930 2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 3.9150 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 2.8660 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 2.2670 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 0.4470 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -0.4580 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 0.3580 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -0.1540 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -2.3220 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 3.1350 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 1.8420 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 3.2800 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 1.9680 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 1.4590 3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.4850 5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -4.0720 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -3.9010 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -3.3830 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 0.8260 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 0.8480 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -0.4480 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 3.1200 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 4.7200 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 4.2990 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 29 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 4 31 1 0 0 0 0 5 16 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 20 1 0 0 0 0 11 36 1 0 0 0 0 12 24 1 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 2 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END > 148 $$$$ 149 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 89 0 0 1 0 0 0 0 0999 V2000 -2.5620 1.1190 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 0.0860 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -1.3100 3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.7710 1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -3.2060 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -3.5420 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -2.5320 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.2950 1.9170 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3810 -4.9380 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -1.9390 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -1.8870 -6.0700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3760 -2.5030 -4.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -1.2390 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -1.9810 -3.3070 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9530 -1.9840 -3.5840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7020 -2.6400 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.7510 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -1.1980 -2.0170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0380 -1.6510 -0.8240 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4820 -0.1070 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -1.0970 -1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.5980 0.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8280 -0.6250 0.2970 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4690 -0.9460 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.2420 2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -2.6060 -7.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -3.3800 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -3.0230 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -1.5900 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -0.9050 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.1620 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 0.7640 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -4.0270 -5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -2.0720 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -1.8980 -8.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.5750 -9.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -0.7180 -8.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 2.1200 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 0.9700 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -1.9850 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -1.3170 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -1.1440 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -1.6880 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -3.9570 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 -1.6230 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 -2.9440 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 -2.2990 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.3460 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -4.9770 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 -5.2120 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -5.6370 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -1.4080 -6.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -2.9640 -5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -0.8430 -6.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.2120 -4.4910 H 0 0 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1.1550 1.4730 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.7190 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -4.3490 -5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -4.4590 -4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -4.3610 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -0.9850 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -2.4860 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -2.4440 -6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.6310 -9.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -2.4790 -10.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -2.1060 -10.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 2 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 22 1 0 0 0 0 8 25 1 0 0 0 0 8 48 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 54 1 0 0 0 0 12 15 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 55 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 19 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 23 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 35 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 M END > 149 $$$$ ATCMD MOE2008 3D 110113 0 0 1 0 0 0 0 0999 V2000 -0.3770 2.8620 0.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 4.0390 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 4.0190 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 3.7630 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 3.3420 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 5.0220 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 5.0870 0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 2.6510 -0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 3.1220 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 4.2820 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 3.9730 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 5.1000 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 4.6330 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 2.6870 1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -3.8370 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -4.6020 -1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -5.6140 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.1300 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -4.6960 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -2.6030 -2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -4.3060 -3.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 -1.4310 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 -1.3620 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 -0.7730 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3140 -2.0470 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 -1.9870 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 -2.8110 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -3.3450 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 -2.8890 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9600 -3.4820 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 -2.2040 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -2.2730 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -1.8810 -1.3470 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5300 -2.4630 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 1.8310 -1.1270 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5230 2.7090 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 0.7820 -0.4710 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0690 -0.5170 -1.3950 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4250 -0.8970 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -0.6600 0.1810 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3710 -1.2300 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 0.8410 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 1.2910 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.9980 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 1.6040 -0.3210 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2420 1.8100 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 1.5840 -1.3670 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3210 1.8240 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -1.6340 -1.1360 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8080 0.1840 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -0.8780 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5910 -0.2920 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -2.6190 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -3.0990 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -3.4330 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 -1.7840 0.2530 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2460 -1.7110 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4510 0.5200 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3390 -0.0510 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 1.4170 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 0.7800 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -1.7350 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -2.0930 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 -2.6140 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -1.1540 -3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -0.3600 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 0.1980 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -1.1850 -4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 0.3160 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -1.1290 0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.1550 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 2.2590 -2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 -2.4440 0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -1.3320 1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -1.7630 1.5280 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2830 -2.7150 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -0.6830 0.8340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5810 -0.1350 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -1.1980 2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 0.3150 1.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 1.1980 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 1.7190 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 0.6480 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0530 1.9520 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 1.1850 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 1.9430 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 0.6250 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 1.7000 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2590 -3.3580 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3990 -3.7940 0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 -3.8100 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -3.0010 2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -4.1940 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -4.6350 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 3.5280 -2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 3.8030 -3.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 4.5650 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 5.5220 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 4.3100 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 4.7100 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 -2.0490 2.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -1.2190 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.3300 -2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -1.5720 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -1.4510 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -0.9680 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 0.4370 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -0.5280 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 0.4020 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 1.1890 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 22 77 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 38 1 0 0 0 0 33 49 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 47 1 0 0 0 0 35 72 1 0 0 0 0 37 38 1 0 0 0 0 37 45 1 0 0 0 0 37107 1 0 0 0 0 38 39 1 0 0 0 0 38 71 1 0 0 0 0 39 40 1 0 0 0 0 39103 2 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 70 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 47 50 1 0 0 0 0 49 51 1 0 0 0 0 49 53 1 0 0 0 0 49106 1 0 0 0 0 50 51 1 0 0 0 0 50 52 2 0 0 0 0 51 62 1 0 0 0 0 51 66 1 0 0 0 0 52 56 1 0 0 0 0 52 58 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 56 57 1 0 0 0 0 56 73 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 58 61 1 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 62 65 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 1 0 0 0 0 70 74 1 0 0 0 0 72 95 1 0 0 0 0 73 89 1 0 0 0 0 74 75 1 0 0 0 0 74 79 2 0 0 0 0 75 76 1 0 0 0 0 75 77 1 0 0 0 0 75101 1 0 0 0 0 77 78 1 0 0 0 0 77 80 1 0 0 0 0 80 81 1 0 0 0 0 80 85 1 0 0 0 0 81 82 1 0 0 0 0 81 83 1 0 0 0 0 81 84 1 0 0 0 0 85 86 1 0 0 0 0 85 87 1 0 0 0 0 85 88 1 0 0 0 0 89 90 2 0 0 0 0 89 91 1 0 0 0 0 91 92 1 0 0 0 0 91 93 1 0 0 0 0 91 94 1 0 0 0 0 95 96 2 0 0 0 0 95 97 1 0 0 0 0 97 98 1 0 0 0 0 97 99 1 0 0 0 0 97100 1 0 0 0 0 101102 1 0 0 0 0 103104 1 0 0 0 0 103105 1 0 0 0 0 107108 1 0 0 0 0 107109 1 0 0 0 0 107110 1 0 0 0 0 M END > 150 $$$$ ATCMD MOE2008 3D 90 93 0 0 1 0 0 0 0 0999 V2000 3.7500 -3.4550 0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -2.0730 1.1940 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5780 -3.1990 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -3.4730 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -3.3630 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.4380 0.3110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3620 -3.2720 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 1.3180 1.0410 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2920 2.0560 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 0.1230 1.4550 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3530 -1.3430 0.6360 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9260 -1.3320 1.0550 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7580 -1.8970 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 0.0070 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 0.5580 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -0.1290 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 0.8310 1.2180 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7600 0.9900 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.2380 1.0740 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9050 2.1520 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -1.9840 0.5050 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3450 0.0990 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.8130 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -0.4260 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -2.8670 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -3.3060 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -3.7470 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.9850 0.9790 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8790 -2.2240 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 0.3430 1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.1180 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 1.4250 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 0.0730 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.0860 2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -1.0670 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 0.0420 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 0.6570 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.1940 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.7410 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.8580 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 0.0300 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -1.2310 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -1.5050 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -2.0650 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.3950 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -1.1410 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -2.0210 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -1.0560 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 1.2400 2.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -1.5400 1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 1.9750 -0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 2.1210 1.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -2.3190 0.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.9360 -1.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -4.2400 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -4.5920 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -3.9900 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -5.6490 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -4.4270 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -5.0120 -0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -3.5200 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -3.7180 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -3.6890 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4990 -2.9450 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -4.6960 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -4.3260 1.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 2.4200 3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 2.1720 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 1.5370 4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 3.1260 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.7050 5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 3.5260 2.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 3.1670 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 3.0520 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 2.2900 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 4.0080 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 2.8590 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 4.1820 2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 3.2980 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 3.6820 -1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 4.2750 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 4.1010 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 4.2610 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 5.2810 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.1880 3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -3.6790 3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -4.1350 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -4.1100 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -3.9330 4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.5510 4.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 21 1 0 0 0 0 6 54 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 51 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 10 34 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 49 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 38 1 0 0 0 0 23 42 1 0 0 0 0 24 28 1 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 46 47 1 0 0 0 0 49 67 1 0 0 0 0 50 85 1 0 0 0 0 51 79 1 0 0 0 0 52 73 1 0 0 0 0 53 61 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 60 2 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 56 59 1 0 0 0 0 61 62 1 0 0 0 0 61 66 2 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 62 65 1 0 0 0 0 67 68 1 0 0 0 0 67 72 2 0 0 0 0 68 69 1 0 0 0 0 68 70 1 0 0 0 0 68 71 1 0 0 0 0 73 74 1 0 0 0 0 73 78 2 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 74 77 1 0 0 0 0 79 80 2 0 0 0 0 79 81 1 0 0 0 0 81 82 1 0 0 0 0 81 83 1 0 0 0 0 81 84 1 0 0 0 0 85 86 1 0 0 0 0 85 90 2 0 0 0 0 86 87 1 0 0 0 0 86 88 1 0 0 0 0 86 89 1 0 0 0 0 M END > 151 $$$$ ATCMD MOE2008 3D 111114 0 0 1 0 0 0 0 0999 V2000 6.8180 -1.9220 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -3.3180 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -3.7760 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7780 -4.1520 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 -5.2300 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 -3.6060 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 -4.2570 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 -2.2250 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0860 -1.7970 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -1.3900 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 -0.3140 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -1.9900 0.5670 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7260 -2.5650 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 2.2000 0.5400 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6730 3.0230 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 1.1790 1.1420 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8860 -0.5230 0.7920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3320 -0.8120 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 0.1080 1.5370 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7410 0.5810 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 1.1900 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 0.7210 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 1.8880 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.9580 0.5410 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1940 2.1880 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 1.8550 0.3330 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6750 2.4670 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -1.9220 0.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7120 0.3910 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -0.4290 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -0.2220 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -2.4150 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -2.2740 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -3.4990 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 -1.7160 -1.0830 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3100 -2.2640 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -1.7170 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -1.8180 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -2.3590 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 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C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -1.3340 1.1680 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4900 -2.3300 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -0.9720 -0.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1170 0.0070 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 0.7480 2.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 -0.7520 -1.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -1.9430 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -1.6570 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -2.4540 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -2.6610 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 -0.0720 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -0.7010 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 0.8500 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 0.2290 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 2.2240 1.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 3.3000 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 4.1860 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5980 3.6410 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 4.6270 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 5.0080 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 3.5320 2.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -2.7460 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0210 -2.7130 -4.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 -3.8420 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -3.4450 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -4.3530 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -4.5840 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 4.1240 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 4.9210 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 4.4940 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 3.9820 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 5.5720 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 4.2310 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 3.2020 1.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 -1.3200 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -0.3840 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 4.2710 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 5.4490 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 5.2040 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 5.7360 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 6.2930 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 4.2900 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -2.7250 -0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -4.0600 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -4.8770 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -4.6250 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -5.9360 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.7540 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -4.5760 -1.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -2.6560 1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -2.3950 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 63 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 28 1 0 0 0 0 12103 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 14 58 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 37 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 56 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 94 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 75 1 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 28110 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 48 1 0 0 0 0 30 52 1 0 0 0 0 31 35 1 0 0 0 0 31 40 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 56 60 1 0 0 0 0 58 88 1 0 0 0 0 59 82 1 0 0 0 0 60 61 1 0 0 0 0 60 65 2 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 61 95 1 0 0 0 0 63 64 1 0 0 0 0 63 66 1 0 0 0 0 66 67 1 0 0 0 0 66 71 1 0 0 0 0 67 68 1 0 0 0 0 67 69 1 0 0 0 0 67 70 1 0 0 0 0 71 72 1 0 0 0 0 71 73 1 0 0 0 0 71 74 1 0 0 0 0 75 76 1 0 0 0 0 76 77 1 0 0 0 0 76 81 2 0 0 0 0 77 78 1 0 0 0 0 77 79 1 0 0 0 0 77 80 1 0 0 0 0 82 83 2 0 0 0 0 82 84 1 0 0 0 0 84 85 1 0 0 0 0 84 86 1 0 0 0 0 84 87 1 0 0 0 0 88 89 2 0 0 0 0 88 90 1 0 0 0 0 90 91 1 0 0 0 0 90 92 1 0 0 0 0 90 93 1 0 0 0 0 94 97 1 0 0 0 0 95 96 1 0 0 0 0 97 98 1 0 0 0 0 97102 2 0 0 0 0 98 99 1 0 0 0 0 98100 1 0 0 0 0 98101 1 0 0 0 0 103104 1 0 0 0 0 104105 1 0 0 0 0 104109 2 0 0 0 0 105106 1 0 0 0 0 105107 1 0 0 0 0 105108 1 0 0 0 0 110111 1 0 0 0 0 M END > 152 $$$$ 153 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 41 41 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.3580 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0220 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.6950 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4210 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 2.0770 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -0.6090 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -1.0010 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -1.8060 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -2.1940 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8270 -2.1930 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 -3.0180 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -0.6880 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -2.1710 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 3.5830 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -2.8060 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.9560 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -4.3760 0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -5.2200 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -6.7080 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -4.7850 3.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 1.8780 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5790 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 1.9890 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 -1.4280 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -3.1480 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 -2.2860 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -1.9150 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -2.4630 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 -3.2370 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 -3.9520 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 3.9660 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 3.9130 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 3.9600 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -3.8860 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -2.2440 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -2.6910 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.7220 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -6.9080 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -7.1310 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -7.1620 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 M END > 153 $$$$ 154 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 84 0 0 1 0 0 0 0 0999 V2000 0.0770 1.3210 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.1500 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.8310 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 2.0140 -0.2500 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5400 1.2640 -0.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2920 2.2740 -1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 3.4420 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 3.3360 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 0.2780 -0.0400 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3110 -0.3240 0.9590 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2800 -0.3350 1.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4900 0.8150 0.7180 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4430 -1.3230 2.1250 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9420 -1.3750 1.8530 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4710 -0.9570 3.2290 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4460 4.1410 -1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 0.2260 2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 1.5330 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -2.6310 2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.3730 1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -1.9820 4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 0.5080 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -0.7820 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 0.6170 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 4.7060 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 2.2370 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.8930 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 0.4940 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -3.3480 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0240 -4.6530 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -5.2640 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 -2.9480 0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -4.4020 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 0.6000 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 0.4650 0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5550 1.1900 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 0.1760 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7530 1.5290 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -2.2970 -0.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.5980 4.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.8190 5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 2.0050 6.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 2.7690 4.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 1.5890 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.7190 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.9160 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 2.1030 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -0.8720 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 1.5220 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 2.3660 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 1.9080 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 0.8330 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -2.9280 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -2.1340 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -1.6090 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -0.4880 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 4.7590 -3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 5.5690 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 4.7030 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.5670 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.6860 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 0.8300 4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 1.1180 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 -5.3400 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 -4.5760 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6490 -6.2070 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -5.4420 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 -3.7150 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 -3.9670 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 -5.3460 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 2.0970 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 -0.0650 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 -0.7310 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 0.6020 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 2.2510 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 1.9550 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1130 0.6220 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -2.8380 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 1.0430 6.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 2.4090 7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 2.6960 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 10 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 11 48 1 0 0 0 0 12 18 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 15 28 1 0 0 0 0 17 34 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 29 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 23 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 27 39 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 40 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 32 2 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 39 78 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 M END > 154 $$$$ 155 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 75 79 0 0 1 0 0 0 0 0999 V2000 -0.3490 0.5440 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -0.8210 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.4150 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -0.6370 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 0.7400 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 1.3210 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -2.3230 -6.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0890 -3.2470 -7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -3.7730 -8.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -3.3880 -8.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -2.4720 -7.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -1.9380 -6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -1.2010 -0.1360 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8580 -0.4630 0.7790 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0290 0.9640 0.1630 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3790 -1.3360 -1.5660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9300 -0.0110 -2.1300 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8650 0.5900 -1.0780 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7020 1.7510 -1.5610 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4490 1.4010 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 0.8850 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 -0.3560 -3.3810 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8690 -0.8680 -4.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 0.8920 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 -1.7430 -2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -0.5130 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 -0.4820 -0.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 -1.0220 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1960 -0.5390 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3010 -2.5480 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 1.8500 1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 2.5810 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 2.4830 1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 3.5220 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 3.0380 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -1.7590 -5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -2.0990 -5.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -1.2670 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -2.4640 -0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 1.0050 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -1.4220 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -2.4800 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 1.3470 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 2.3860 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 -3.5480 -7.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -4.4880 -8.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -3.8030 -9.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.1750 -7.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -1.2240 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -2.2090 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -0.4350 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 1.3960 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 -2.1000 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 1.9390 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9540 2.2930 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 0.6340 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7590 1.6580 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 0.6100 -4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 -1.1190 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 1.2020 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 1.7720 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 0.3480 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -2.5870 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 -0.8860 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1990 -0.9400 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 0.5500 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 -2.9130 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 -2.9000 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -2.9220 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 4.5030 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 3.6100 3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 3.1350 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 3.2520 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 3.8590 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 2.9240 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 26 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 51 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 23 36 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 70 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 36 37 2 0 0 0 0 38 39 2 0 0 0 0 M END > 155 $$$$ ATCMD MOE2008 3D 103106 0 0 1 0 0 0 0 0999 V2000 5.9070 -0.6260 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 0.6070 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 0.7700 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 1.6350 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5820 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 1.4460 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 2.2460 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 0.2290 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 0.0810 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -0.8010 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 -1.7450 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -2.2410 1.2880 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7400 -2.7800 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 1.3570 1.8730 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8080 0.9530 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 0.3360 2.1080 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4790 -1.1500 1.4370 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8120 -1.7510 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -0.8610 1.9860 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3370 -0.6360 3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 0.4810 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 1.1320 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 0.3730 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 1.1990 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 1.8900 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.8080 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 1.6180 0.5450 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2250 1.8350 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -1.5890 0.9540 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8270 0.4130 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -0.7850 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 0.1750 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -2.3200 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -2.8080 2.2090 H 0 0 0 0 0 0 0 0 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-0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 3.8190 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 4.1810 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 3.3330 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 4.6590 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 4.8870 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 4.6220 3.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -0.9130 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 65 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 12 90 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 14 59 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 38 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 57 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 77 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 29103 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 49 1 0 0 0 0 31 53 1 0 0 0 0 32 36 1 0 0 0 0 32 41 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 57 61 1 0 0 0 0 59 97 1 0 0 0 0 60 84 1 0 0 0 0 61 62 1 0 0 0 0 61 67 2 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 62 65 1 0 0 0 0 65 66 1 0 0 0 0 65 68 1 0 0 0 0 68 69 1 0 0 0 0 68 73 1 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 69 72 1 0 0 0 0 73 74 1 0 0 0 0 73 75 1 0 0 0 0 73 76 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 78 83 2 0 0 0 0 79 80 1 0 0 0 0 79 81 1 0 0 0 0 79 82 1 0 0 0 0 84 85 2 0 0 0 0 84 86 1 0 0 0 0 86 87 1 0 0 0 0 86 88 1 0 0 0 0 86 89 1 0 0 0 0 90 91 1 0 0 0 0 91 92 1 0 0 0 0 91 96 2 0 0 0 0 92 93 1 0 0 0 0 92 94 1 0 0 0 0 92 95 1 0 0 0 0 97 98 1 0 0 0 0 97102 2 0 0 0 0 98 99 1 0 0 0 0 98100 1 0 0 0 0 98101 1 0 0 0 0 M END > 156 $$$$ 157 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 104107 0 0 1 0 0 0 0 0999 V2000 -0.8220 -1.2060 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -7.1920 6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -8.2870 6.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 -9.5500 6.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -9.7180 7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -8.6230 8.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 -7.3600 7.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -7.9030 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -4.2010 0.9210 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8740 -3.8780 0.5690 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6000 -2.1690 3.1830 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2440 -3.1100 1.7420 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6580 -3.0130 3.1320 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6250 -2.3830 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -2.7090 4.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5480 -2.5190 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -3.4770 1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -2.8370 2.8350 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7690 -3.8700 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -4.8780 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -4.6360 3.3150 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5650 -3.5170 4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -6.1090 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.5420 5.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -5.8410 4.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -4.0170 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -4.0840 4.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -5.4380 1.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.5690 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -1.7650 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -1.7600 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -0.8740 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -0.9590 1.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 -2.4240 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -6.5800 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -6.5460 -0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -4.3640 5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -5.7700 5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 0 7.7850 -6.5050 8.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -8.2830 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -8.6140 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -7.7680 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -4.3530 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -4.6200 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -1.3280 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -2.0320 4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -1.4920 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -2.7520 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -4.4890 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -3.4490 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -4.3040 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -3.9330 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -2.8290 4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -6.8660 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -6.4990 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -5.8520 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -1.8160 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -0.5730 5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.4510 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -1.0180 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -1.8660 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -0.3100 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -0.1830 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.4990 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -1.3460 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -2.9120 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -1.6680 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -3.1660 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -6.0820 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -6.4420 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 -5.0800 6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.4640 6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 1.3020 5.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -0.3150 6.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 -6.2280 6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2180 -5.0100 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4170 -4.5160 6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -6.7370 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9240 -6.2610 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 -7.4880 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -8.0130 5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -7.9340 5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -8.8010 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 41 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 2 40 1 0 0 0 0 3 4 2 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 57 1 0 0 0 0 5 6 2 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 59 1 0 0 0 0 7 60 1 0 0 0 0 8 35 1 0 0 0 0 8 61 1 0 0 0 0 8 62 1 0 0 0 0 8 63 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 9 64 1 0 0 0 0 10 19 1 0 0 0 0 10 29 1 0 0 0 0 10 65 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 11 43 1 0 0 0 0 11 66 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 24 2 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 67 1 0 0 0 0 16 17 1 0 0 0 0 16 68 1 0 0 0 0 16 69 1 0 0 0 0 17 70 1 0 0 0 0 17 71 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 72 1 0 0 0 0 22 73 1 0 0 0 0 22 74 1 0 0 0 0 23 75 1 0 0 0 0 23 76 1 0 0 0 0 23 77 1 0 0 0 0 24 78 1 0 0 0 0 24 79 1 0 0 0 0 25 50 1 0 0 0 0 27 37 1 0 0 0 0 28 35 1 0 0 0 0 29 41 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 30 82 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 32 85 1 0 0 0 0 33 86 1 0 0 0 0 34 87 1 0 0 0 0 34 88 1 0 0 0 0 34 89 1 0 0 0 0 35 36 2 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 40 47 1 0 0 0 0 40 92 1 0 0 0 0 41 42 2 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45 93 1 0 0 0 0 45 94 1 0 0 0 0 45 95 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 48 96 1 0 0 0 0 48 97 1 0 0 0 0 48 98 1 0 0 0 0 49 99 1 0 0 0 0 49100 1 0 0 0 0 49101 1 0 0 0 0 50 51 1 0 0 0 0 50 52 2 0 0 0 0 51102 1 0 0 0 0 51103 1 0 0 0 0 51104 1 0 0 0 0 M END > 157 $$$$ ATCMD MOE2008 3D 104107 0 0 1 0 0 0 0 0999 V2000 4.5720 -2.8410 -1.8110 C 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -6.6300 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -7.5390 2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -8.0710 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -7.4120 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -6.7250 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -5.8500 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -5.6970 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -8.1260 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -8.2790 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -7.8320 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -7.5660 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -5.8800 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -6.5070 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 2 49 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 4 53 1 0 0 0 0 5 8 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 57 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 59 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 33 1 0 0 0 0 16 36 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 29 1 0 0 0 0 22 32 2 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 26 28 1 0 0 0 0 27 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 30 2 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 69 1 0 0 0 0 31 32 1 0 0 0 0 32 70 1 0 0 0 0 33 34 2 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 72 1 0 0 0 0 35 36 1 0 0 0 0 36 73 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 39 76 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 42 77 1 0 0 0 0 43 44 1 0 0 0 0 43 78 1 0 0 0 0 43 79 1 0 0 0 0 44 80 1 0 0 0 0 44 81 1 0 0 0 0 44 82 1 0 0 0 0 45 83 1 0 0 0 0 45 84 1 0 0 0 0 45 85 1 0 0 0 0 M END > 160 $$$$ 161 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 63 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.6310 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 0.0130 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -2.1370 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 2.0500 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 1.2720 5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 0.8250 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 2.4280 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 1.9990 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 1.2010 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 0.8940 4.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 2.2300 2.4910 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8550 1.5030 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 1.9770 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3780 1.5960 1.1660 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6910 3.7120 2.4520 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8640 4.0710 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 3.5270 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1430 3.6870 0.1900 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8160 4.5740 2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 4.5540 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 2.2380 0.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6700 1.5750 -0.8170 N 0 0 3 0 0 0 0 0 0 0 0 0 2.2540 1.4890 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.4810 2.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 0.2560 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 3.9330 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 0.5160 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 3.9910 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 0.0370 5.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 0.7080 6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.9550 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -2.4980 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -2.4670 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.5340 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 2.3740 4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 1.0110 6.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 0.2180 6.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 3.0180 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 3.6670 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 5.1650 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 4.0270 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 4.2660 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 5.5850 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 2.1600 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 0.4620 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 2.1400 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -0.3850 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.1900 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 0.3630 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -0.0170 6.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 1.2020 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 1.4520 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 1.6030 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 1.5770 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 3.0440 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 11 2 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 26 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 25 1 0 0 0 0 16 23 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END > 161 $$$$ 162 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 94 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.5930 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.0640 -0.0810 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4090 -2.0240 -0.2360 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6800 -2.3500 -1.0480 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5230 -1.3700 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -0.0580 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -0.4900 -0.1700 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2990 -6.1270 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -6.8210 0.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8860 -6.2400 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -6.4100 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -5.9060 -0.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4140 -6.3330 -1.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1170 -5.6540 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -4.1920 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -4.6560 -0.1440 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6800 -3.8110 -1.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3770 -2.7470 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -3.9220 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -8.2240 0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7110 -7.0710 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 -4.8020 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -1.9600 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -2.3980 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.4010 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 2.1440 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 3.6730 -0.1790 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7290 4.2220 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 4.1660 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 5.3250 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 5.9090 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 5.8990 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 3.7030 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 5.7510 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 3.7910 0.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -6.0360 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -0.1640 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.9230 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.9600 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.3000 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 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0 0 0 0 0 2.7160 4.0320 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 4.0940 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 2.6140 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 6.1210 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 6.1420 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 6.0800 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 4.1030 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.3900 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -6.3270 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 7 1 0 0 0 0 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 18 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 47 1 0 0 0 0 10 13 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 17 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 70 1 0 0 0 0 24 71 1 0 0 0 0 24 72 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 25 75 1 0 0 0 0 26 27 1 0 0 0 0 26 76 1 0 0 0 0 26 77 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 78 1 0 0 0 0 28 33 1 0 0 0 0 28 34 1 0 0 0 0 28 35 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 34 87 1 0 0 0 0 35 88 1 0 0 0 0 36 89 1 0 0 0 0 36 90 1 0 0 0 0 M END > 162 $$$$ 163 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.2130 1.4900 0.3060 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6800 1.6800 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 1.6500 -1.6130 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0860 0.0000 0.4660 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2660 -0.3990 -0.4260 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1620 -1.3410 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -1.1940 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.3040 1.9190 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7710 -1.0940 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 0.2430 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -0.2680 -3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -1.6850 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -2.6160 -2.8610 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2030 -1.9680 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 2.1610 1.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.5840 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -1.0440 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.0980 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -1.5260 3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -2.1670 1.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.6230 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 0.8500 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -3.9510 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 2.5740 -2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 2.1010 -2.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 3.3680 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 3.9440 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 4.0460 -1.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 1.9080 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 2.6390 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 0.8780 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -1.0540 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -2.3710 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -0.7330 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -2.1750 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -0.8740 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 -0.3420 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 0.3220 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -1.7560 -4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.9720 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.7850 -3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.2340 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 3.1120 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.7780 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -0.6120 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 0.2140 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.2710 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -1.9710 4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -0.6810 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -2.8100 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 0.5540 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 1.4680 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 1.4190 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -3.7790 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -4.6120 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -4.4130 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 2.5540 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 3.5920 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 2.2360 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 3.1900 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 4.2510 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 4.8090 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 10 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 17 1 0 0 0 0 8 21 1 0 0 0 0 9 14 2 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 M END > 163 $$$$ 164 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 48 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -2.0210 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -2.6130 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 2.1730 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -6.6760 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -6.0390 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -4.5350 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.1170 -1.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7240 -0.5170 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 0.5820 1.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -0.1040 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.4690 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -0.5490 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -0.5300 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -4.6380 -2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -4.6640 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -8.1790 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -8.7600 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -8.5950 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -8.6740 -0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 2.0300 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.6100 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.0240 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 1.6460 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 3.2530 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -6.1230 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -6.5910 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -4.1180 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -4.1640 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.2160 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.0960 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -1.5020 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -0.6650 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 0.1980 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -0.1810 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -1.6200 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -0.1650 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -4.3400 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -5.7260 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -4.2200 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -4.3760 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -8.3830 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -9.8480 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -8.4640 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -8.1810 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -9.6820 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -8.2170 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -8.4480 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 2 23 1 0 0 0 0 3 8 1 0 0 0 0 3 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 M END > 164 $$$$ 165 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3850 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6810 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.1100 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4540 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.0460 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -0.6440 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 0.2030 0.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7260 1.5460 -0.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5380 2.1650 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 -1.8330 -0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.0370 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 2.0400 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 2.4440 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 2.5780 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 3.4020 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 4.0910 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 3.9570 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 3.1370 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 0.4190 1.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -0.4810 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 -0.3220 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -1.4190 1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.1900 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -0.2940 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 1.3780 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -2.4270 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 2.2250 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 2.0400 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 3.5060 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9210 4.7330 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 4.4950 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 3.0320 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 0.5740 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 -1.1930 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 -0.2330 4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 6 2 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M END > 165 $$$$ 166 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 58 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4130 -2.0590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.5790 0.2660 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8190 -4.0890 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -4.5890 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -6.1000 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -6.6000 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 -8.1100 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -8.6100 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -10.1200 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 -10.6200 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -12.1310 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8250 -12.6310 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7990 -14.1410 3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2000 -14.6340 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6980 -15.6020 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 3.5790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 1.4290 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -0.1580 -1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -2.0850 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -2.3020 -0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -2.4860 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.3480 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -4.5910 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -4.3080 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -4.0880 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -4.3710 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -6.6010 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -6.3180 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -6.0980 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -6.3810 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -8.6120 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -8.3280 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4400 -8.1080 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6590 -8.3920 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -10.6220 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -10.3390 2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -10.1190 3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 -10.4020 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9960 -12.6320 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 -12.3490 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2320 -12.1290 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 -12.4120 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -14.6430 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1730 -14.3600 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7940 -14.1880 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1040 -16.0470 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7020 -15.9540 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 3.9820 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 3.9180 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 3.9270 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -0.5000 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -2.7110 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 23 58 1 0 0 0 0 25 59 1 0 0 0 0 M END > 166 $$$$ 167 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 56 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4130 -2.0590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.5790 0.2660 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8190 -4.0890 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -4.5890 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -6.1000 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -6.6000 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 -8.1100 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -8.6100 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -10.1200 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 -10.6200 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -12.1310 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8250 -12.6310 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7990 -14.1410 3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1670 -14.6220 3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2590 -15.0060 3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 3.5790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 1.4290 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -0.1580 -1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -2.0850 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -2.3020 -0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -2.4860 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.3480 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -4.5910 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -4.3080 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -4.0880 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -4.3710 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -6.6010 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -6.3180 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -6.0980 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -6.3810 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -8.6120 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -8.3280 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4400 -8.1080 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6590 -8.3920 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -10.6220 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -10.3390 2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -10.1190 3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 -10.4020 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9960 -12.6320 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 -12.3490 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2320 -12.1290 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 -12.4120 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -14.6430 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1730 -14.3600 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2350 -15.3490 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 3.9820 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 3.9180 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 3.9270 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -0.5000 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -2.7110 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 3 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 23 56 1 0 0 0 0 25 57 1 0 0 0 0 M END > 167 $$$$ 168 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0950 1.1850 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.3130 -0.4590 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2630 -0.6060 -1.6420 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4250 1.9060 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.7210 -1.3360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5280 0.2230 -1.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4860 -0.0180 -2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 0.5120 -2.3170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6740 2.3410 -1.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7820 1.9940 -2.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6680 2.7990 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 4.1850 -2.7650 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9060 4.7020 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 3.8300 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -2.1000 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -0.1840 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 2.5370 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2360 3.7990 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 4.6720 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 5.8020 -1.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.4400 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.9850 -0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 2.4090 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -1.4110 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.1160 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -1.2290 1.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -2.9060 -1.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.5820 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.3480 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.7060 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 2.9680 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 1.4900 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -0.1380 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.0820 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.4990 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 0.3520 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 1.8670 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 2.4430 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 2.8190 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 4.8790 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 5.7240 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 4.7310 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 4.0970 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 4.0480 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -2.3690 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.2680 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -1.1390 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 1.9860 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 4.3100 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.5410 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.5270 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.2150 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 3.4880 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 2.1660 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 2.0670 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -2.1870 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -3.1170 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -1.5530 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -3.8550 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 27 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 27 59 1 0 0 0 0 M END > 168 $$$$ 169 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0970 1.1910 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.3070 -0.4580 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2630 -0.5980 -1.6420 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4270 1.9110 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.7290 -1.3340 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5270 0.2310 -1.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4810 -0.0090 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 0.5200 -2.3270 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6770 2.3440 -1.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7820 2.0000 -2.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6690 2.8150 -3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 4.1960 -2.7540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9180 4.7100 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.8310 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.0920 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 -0.1810 -1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 2.5350 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 3.7990 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 4.6620 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.4320 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 2.4200 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 5.7940 -1.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.9680 -0.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -2.9110 -1.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -4.2400 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -5.1550 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -4.7030 -1.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.5880 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.3530 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -0.7010 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 2.9720 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 1.4920 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.1310 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.0730 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 0.5070 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 0.3630 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 1.8630 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 2.4610 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 2.8440 -3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 4.8930 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 5.7300 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 4.7400 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 4.1040 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 4.0360 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3600 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -2.2590 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -1.1350 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 1.9780 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 4.2930 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.5480 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.5190 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -1.2080 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 3.4990 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 2.1800 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 2.0770 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -0.8540 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.4340 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -6.0520 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -4.6400 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 22 2 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 M END > 169 $$$$ 170 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.1060 1.2000 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -0.2980 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.5960 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 1.9190 -0.0910 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3270 1.7320 -1.3350 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5320 0.2330 -1.5520 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4850 -0.0060 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 0.5200 -2.2940 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6820 2.3650 -1.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7840 2.0110 -2.0530 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6600 2.8130 -3.3590 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0350 4.2320 -2.8300 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8330 4.7190 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 3.8560 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.0890 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -0.4440 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 1.3740 1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 2.4100 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -0.1290 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 0.1950 -3.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 1.9040 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 2.5440 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 3.9440 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1590 4.8040 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 1.9230 -0.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 2.4010 -4.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 1.9540 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 2.8860 2.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 1.4410 3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 1.6000 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.3630 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.7030 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -0.7960 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 2.9830 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -1.0670 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 0.5240 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 0.0300 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 2.8010 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 4.9160 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 5.7530 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 4.7080 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 4.1130 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 4.0970 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -2.7060 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -2.3630 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -2.2490 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.5350 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.5330 -3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -1.2230 -3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 3.4890 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 2.1690 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 2.0550 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -0.7540 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 5.8120 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 4.4920 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 2.8880 -5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 0.6030 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 2.2390 3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 1.1110 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 27 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 23 24 2 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 M END > 170 $$$$ ATCMD MOE2008 3D 59 62 0 0 1 0 0 0 0 0999 V2000 -1.8970 0.0190 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 0.3630 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 0.5940 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -1.4800 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -1.6930 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -1.6680 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.4420 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 0.2940 0.5840 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9860 -0.1900 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -0.3350 -0.2440 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3910 -1.6580 0.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2690 -1.3150 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.4970 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.9610 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -3.3220 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -1.6910 -1.0350 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6370 -2.2840 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 0.5390 -0.5210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3950 0.6600 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -0.3250 -0.3660 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7820 0.7080 -0.9290 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4200 1.1910 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 1.5890 0.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9180 1.4310 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 2.8050 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 3.6020 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 3.2290 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 2.1380 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 2.7070 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 2.2660 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 0.7590 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -0.5090 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -1.4880 1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.9460 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 0.1260 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 1.9180 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.1640 -1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 0.9100 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -0.6150 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -1.0570 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 0.3210 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -1.2900 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.5510 -2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -1.2350 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 1.7050 0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 2.3860 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 1.6000 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 1.0470 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 0.9370 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 2.2950 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 3.6040 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -3.0610 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -2.3170 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -3.7530 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -3.6320 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -3.6200 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -4.0690 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.2870 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -4.4180 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 7 11 1 0 0 0 0 7 52 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 31 34 2 0 0 0 0 32 33 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 46 51 2 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 56 59 1 0 0 0 0 M END > 171 $$$$ 172 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0890 1.1710 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.3270 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -0.6240 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.8950 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.7070 -1.3410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5180 0.2080 -1.5480 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4850 -0.0360 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 0.4870 -2.2550 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6620 2.3450 -1.0490 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7790 1.9800 -2.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6700 2.7710 -3.3360 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0530 4.1900 -2.8150 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8510 4.6960 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 3.8390 -0.7820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6510 -2.1160 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.4670 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -0.1470 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 2.3860 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 3.8990 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 2.5100 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 4.7480 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 1.8930 -0.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 4.1880 0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 2.3440 -4.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 0.1560 -3.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 5.2360 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 5.6580 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 5.8410 0.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 1.8970 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.5660 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.3360 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.7210 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -0.8320 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 2.9570 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.4830 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -1.0960 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 0.4970 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 0.0010 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 2.7630 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 4.8650 -3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 5.7270 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 4.7130 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 4.0820 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.7330 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3880 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -2.2770 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.5120 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.5560 -3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.2450 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 3.4660 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 2.1410 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 2.0370 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 5.7490 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 4.4340 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 2.8240 -5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 -0.7940 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 4.9990 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 6.6840 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 5.5950 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 23 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 23 26 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 M END > 172 $$$$ 173 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0990 1.1900 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.3080 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.6020 -1.6380 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4290 1.9110 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.7260 -1.3360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5270 0.2280 -1.5490 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4930 -0.0120 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 0.5130 -2.2640 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6720 2.3600 -1.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7840 2.0050 -2.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6640 2.7990 -3.3390 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0310 4.2220 -2.8150 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8270 4.7110 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 3.8510 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 3.9400 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 2.5480 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 1.9380 -0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 4.8000 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 2.3860 -4.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -2.0960 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -0.4440 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 2.4070 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 0.1880 -3.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.9170 -1.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -4.2450 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -5.1620 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -4.7070 -1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.5890 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.3520 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.7060 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -0.8100 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 2.9730 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.4940 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -0.1290 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -1.0720 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 0.5200 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 0.0250 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 1.9000 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 2.7790 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 4.9030 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 5.7450 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 4.7060 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 4.1040 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 4.0970 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 5.8020 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9490 4.4920 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5890 2.8690 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -2.3660 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -2.2590 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.5360 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.5330 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -1.2210 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 3.4860 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 2.1660 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 2.0550 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -0.7610 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -5.4440 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -6.0560 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.6470 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 17 2 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 24 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 M END > 173 $$$$ 174 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 1.8110 3.2560 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 2.2010 -0.4010 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6860 1.0230 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 2.6370 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 1.5350 1.6260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0090 0.4900 1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8520 -0.6550 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -1.3710 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 0.8660 1.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2810 -0.4110 2.6740 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6850 1.1840 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 1.8730 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6730 -0.1490 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 -1.1160 2.6180 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6360 -2.4360 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 -2.8130 3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 -0.4040 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 -1.7530 4.8310 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0060 -2.1000 5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6550 -0.9960 6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7610 0.3010 5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 0.6590 4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 2.7970 -0.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 2.1950 2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -0.1000 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 -1.7360 6.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2220 1.4280 6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 1.8220 4.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 3.3390 -1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 1.6840 2.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7770 0.1420 4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -1.4150 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.4100 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0910 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 3.9750 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 3.3170 -2.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 4.0510 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 3.7060 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 1.8280 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 2.1980 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 3.4040 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.0490 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -0.3000 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -1.3790 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -2.2020 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -1.7650 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 0.6160 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 2.7330 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 2.2060 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 -2.4420 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -3.2190 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -3.7740 4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7130 -2.9100 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 -3.0280 5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5740 -2.2790 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 -0.8180 6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 -1.3140 6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 2.8330 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.4270 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 2.7970 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -0.9980 4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 0.6870 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 0.2310 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -2.7140 6.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 -0.9790 6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -1.5020 5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1950 1.1760 6.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 2.3570 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 1.5520 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -0.6600 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8440 1.0740 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7530 -0.0990 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 -0.4820 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -1.9130 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -2.0620 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 1.5660 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.6120 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 2.3300 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -0.3720 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.9610 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 0.2750 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 3.9000 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 5.0250 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 3.4610 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 2 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 31 1 0 0 0 0 22 28 2 0 0 0 0 23 29 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 29 35 1 0 0 0 0 29 36 2 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 M END > 174 $$$$ 175 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.2580 1.5190 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.0140 0.0940 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7390 -0.7610 1.2430 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7420 1.8750 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 1.1670 1.5370 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1810 -0.3330 1.4330 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6360 0.6940 2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 1.4280 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -0.8070 2.5290 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8460 -1.0580 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 1.7660 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.3880 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.6660 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.3680 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.7730 -3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -0.0250 -2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.6400 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -2.1560 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -1.4990 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -2.4380 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -3.1120 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 -4.0630 4.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -4.6870 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -2.8120 5.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 2.0360 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 1.8480 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.2260 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 1.5660 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 2.9540 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 0.8550 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 1.0840 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 1.0780 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 2.5000 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -1.2070 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.7080 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -2.1320 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 1.7430 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.1850 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 2.7970 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -1.8030 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -0.6930 -4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.1160 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -1.1510 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -1.0940 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.4130 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -2.5210 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -1.2320 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -2.7040 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 -5.1700 6.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 -5.4320 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 -3.9280 6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 M END > 175 $$$$ 176 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.2280 1.4890 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.0160 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.7680 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.8400 0.3810 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3660 1.1330 1.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1070 -0.3710 1.5110 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7360 -1.1340 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -0.5140 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 1.2950 1.4360 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5040 0.5730 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 1.3700 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 2.6590 2.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 2.7240 1.6100 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7170 0.9480 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 3.1910 0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 0.8600 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.7460 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -0.7200 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.5490 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -2.2720 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 3.2800 0.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 4.0030 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 3.4520 -1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 5.5020 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 2.0100 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 1.8150 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.2690 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.3180 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 1.5340 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.2140 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -2.1420 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -0.9720 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 3.4100 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 4.0790 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 1.7550 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 1.1550 3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 2.7670 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -1.0230 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.9880 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 0.5200 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -2.4570 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -2.8480 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.5730 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 5.8140 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 5.8050 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 5.9700 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 15 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 M END > 176 $$$$ 177 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.3060 0.3400 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -3.2660 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -3.1710 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.9010 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -1.2170 1.4160 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3490 -1.8950 2.4430 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6980 -2.2160 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -0.9200 1.3120 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4430 -0.2420 0.2850 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0940 0.0790 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.1550 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 0.9680 -0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -1.2410 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 -0.0300 2.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 -0.4940 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 0.3460 4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -1.5860 3.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -2.1340 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -4.3380 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 0.0600 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -1.2270 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 1.1360 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 0.5650 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -2.4300 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -4.1800 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -1.6970 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -2.6990 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -2.8840 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -0.9100 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 0.5620 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.7470 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -1.6060 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -2.5440 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -2.9830 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 1.4520 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -1.7600 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 1.2900 4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 -0.1880 5.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 0.5440 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -1.6380 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -2.3170 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -3.0820 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.3200 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -4.2690 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -5.2690 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 0.7750 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4170 -0.1450 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 0.4740 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 18 1 0 0 0 0 13 20 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 M END > 177 $$$$ 178 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 91 0 0 1 0 0 0 0 0999 V2000 -2.2020 3.6560 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 2.1490 0.3920 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6570 1.4280 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 3.9350 0.2240 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1340 3.2300 1.2760 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1680 1.7460 1.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4300 0.9660 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.8500 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 3.5120 1.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2520 2.6870 -0.0750 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3120 5.2850 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 5.0060 0.9430 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8750 4.5790 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 3.5130 -1.0770 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9340 2.6890 -1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 2.3210 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 4.7700 -0.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0630 3.4810 -0.8250 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4020 3.6440 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 4.8520 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3490 6.1350 -1.1410 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 5.9970 -0.4190 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8680 1.8870 0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 1.7670 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 3.8990 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 6.0620 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 3.0610 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 1.6970 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 5.6680 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 4.2490 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1450 6.5140 -2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.0920 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 1.8510 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 1.5850 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 2.0320 -1.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 5.3440 0.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 4.1350 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 4.0690 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 1.7760 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 3.6060 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 1.3650 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.1720 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 0.4950 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.1880 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 2.4410 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 3.1770 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 6.1140 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 5.4480 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 1.7680 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 3.2490 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 1.4900 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 1.9810 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 4.9420 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 2.7390 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 3.7640 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 4.6920 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 4.9690 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 6.9420 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 6.8900 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 1.2700 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 1.4250 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 2.8450 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 3.9280 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 3.3250 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 4.9150 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 5.3210 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 7.0570 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 5.8530 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 2.0390 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 3.7300 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 3.1130 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 1.0310 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 2.2510 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 1.1090 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 4.9840 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 4.7550 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 3.5280 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 5.7120 -3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 7.4330 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 6.6680 -3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -0.3840 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.6290 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -0.3370 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 1.4480 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 2.4310 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3540 0.6840 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 46 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 47 1 0 0 0 0 12 29 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 58 1 0 0 0 0 22 26 1 0 0 0 0 22 59 1 0 0 0 0 23 33 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 36 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 M END > 178 $$$$ 179 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 77 82 0 0 1 0 0 0 0 0999 V2000 0.1180 1.4750 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.1770 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -0.2440 -0.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 0.7710 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 1.8570 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 3.0040 -5.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1600 2.9390 -5.8760 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6390 1.6710 -5.1800 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0060 1.5330 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 2.7440 -4.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5080 1.5870 -3.7250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8050 2.5020 -3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 2.7250 -4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 2.5780 -2.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9380 1.5990 -2.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9350 1.5940 -1.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1090 1.2510 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 1.9460 0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 2.3450 -0.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2340 4.0580 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 0.2560 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 3.6690 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 1.3310 -2.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 0.3720 0.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 2.8170 -7.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 2.1710 -7.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 2.0570 -7.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7560 2.0180 -7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 4.2060 -8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 4.4580 -6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 4.6780 -7.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 2.3960 -7.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 3.7960 -8.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 4.0980 -9.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 3.8420 -5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 0.1580 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 2.8700 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 0.4780 -5.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1630 -0.5640 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 -1.8400 -6.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1250 -0.4780 -5.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -0.4240 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 0.7220 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 2.8340 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 1.7270 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 1.5360 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 3.2780 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 1.9360 -5.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 3.6780 -5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 0.7600 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 3.3600 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 4.2280 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 4.2920 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 4.6990 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 0.1380 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 0.2820 -4.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -0.5820 -3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 1.0240 -6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5990 2.5120 -7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 1.9600 -8.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 1.0110 -7.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 4.7970 -7.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 4.0980 -9.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 4.7100 -7.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 5.0950 -6.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 4.7830 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 2.3460 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 1.6920 -8.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 0.0380 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 0.0300 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -0.5910 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 3.2110 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 2.6770 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 3.6380 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -1.7290 -7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -2.6610 -5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 -2.0520 -7.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 27 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 45 1 0 0 0 0 9 11 1 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 22 1 0 0 0 0 11 15 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 24 2 0 0 0 0 18 19 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 32 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 33 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 2 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 M END > 179 $$$$ 180 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 77 82 0 0 1 0 0 0 0 0999 V2000 -0.2280 1.6470 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 0.1420 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 2.2930 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 8.5580 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 8.6680 4.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 9.9710 4.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 10.7050 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 9.8710 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 5.7960 -1.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6780 4.2670 -1.5500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3930 3.7280 -0.9320 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2420 4.1320 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 6.1520 0.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4060 5.5790 0.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5450 8.0490 1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 7.6440 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 6.8440 2.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4340 5.8660 2.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3220 4.6710 3.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0420 5.2640 4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 6.2390 5.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 7.2890 4.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9410 6.2640 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 6.3140 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 5.6520 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 3.2590 1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 4.8410 5.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 4.2480 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 5.5800 -3.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 6.3380 -2.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4460 3.2680 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 3.8540 -3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 6.1810 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 7.2290 -2.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 7.8220 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 8.1240 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 9.2010 -3.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 3.7230 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 6.5990 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 3.7420 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 2.2710 -0.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.2390 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -0.2480 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.1760 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 7.8480 5.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 11.7820 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 10.1510 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 4.0970 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 8.6290 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 8.7010 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 8.1970 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 7.9670 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 4.0840 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 7.5250 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 5.5370 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 5.7760 3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 7.0700 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 6.1160 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 7.3860 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 5.9530 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 6.1200 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 2.2590 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 3.3020 -4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 3.5470 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 4.5760 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 3.8460 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 2.8620 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 5.2920 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 6.5080 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 8.4160 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 8.0700 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 7.4730 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 6.9140 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 5.9180 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 3.4390 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 2.8600 3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 4.2610 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 41 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 30 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 48 1 0 0 0 0 12 14 1 0 0 0 0 12 26 2 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 27 2 0 0 0 0 21 22 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 30 35 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 36 1 0 0 0 0 35 36 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 36 37 2 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 M END > 180 $$$$ 181 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.2760 1.3520 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.1510 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 3.2730 -3.5110 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2410 2.6420 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 2.3030 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 3.9430 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 3.4090 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 3.2740 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 3.5340 0.0890 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0360 4.0860 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 4.1530 0.7070 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6380 3.1320 0.7690 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3870 3.4780 1.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 4.1820 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 4.5600 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 4.4750 3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 5.1250 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 2.0920 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 0.8650 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 2.1250 -2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 1.8920 0.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 4.2590 -4.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 4.4490 -5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 5.4560 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 3.8140 -5.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.5460 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.5510 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.4440 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 2.4970 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 1.7360 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 3.3530 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 4.8900 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 4.2480 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 3.7780 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 5.1580 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 3.9120 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 5.0250 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 2.1360 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 5.3620 3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 5.3470 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 0.4140 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 0.8160 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 0.3230 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 1.3340 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 1.8460 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 2.2660 -4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 4.9690 -7.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 5.8660 -7.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 6.2620 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 21 2 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 8 2 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 10 1 0 0 0 0 7 20 1 0 0 0 0 8 12 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M END > 181 $$$$ 182 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.3390 1.5890 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 0.0860 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.6760 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 1.9320 0.3600 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4940 1.2610 1.5670 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2490 -0.2430 1.4820 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9270 -0.9390 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -0.4990 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 1.4820 1.5100 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7620 0.7150 2.6100 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8930 1.7550 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 3.0220 3.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 2.9440 1.7800 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3490 3.3770 0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 1.1680 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 1.8580 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -0.5820 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.5420 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -2.1730 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 3.3740 0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 4.0340 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 3.4260 -1.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 5.5340 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 0.3500 2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 2.1000 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 1.9360 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -0.1510 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.2310 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.5670 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -1.8170 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -1.0530 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 1.7280 4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 1.5590 4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 3.6140 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 4.2920 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.8100 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 1.2920 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 2.8970 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.0640 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.9780 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 0.5120 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.3050 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -2.7600 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.5070 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 5.9020 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 5.8040 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 5.9800 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 -0.0680 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 M END > 182 $$$$ 183 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 89 94 0 0 1 0 0 0 0 0999 V2000 0.0250 1.2770 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 0.0400 -0.2350 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5700 -1.1330 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 0.9810 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -0.1280 1.7320 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8520 -1.3560 1.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9520 -2.4820 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -2.9070 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -0.4910 1.9140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3080 -1.7430 2.7580 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3110 0.3300 2.8160 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8600 0.6960 2.4680 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7390 -1.1000 3.0630 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7680 -2.1950 2.6180 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0420 -3.4730 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -3.8800 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -1.5140 2.9500 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4410 -2.7660 3.7910 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8860 -3.2440 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8700 -2.1260 3.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -0.9120 3.0570 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2010 -0.4010 3.1970 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0380 0.3310 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.9340 1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 0.4160 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 0.3240 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 -2.5490 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 -0.2300 4.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -1.5040 4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 1.7200 1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -2.4960 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9530 -1.2440 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.3860 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 0.8140 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 1.1390 -2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 0.9870 -2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 3.0830 2.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 2.0840 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.6180 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.2420 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 0.6720 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 1.8980 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -1.7040 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.1710 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -3.3460 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -3.7340 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -3.2420 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -0.6720 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 1.0450 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 1.1130 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -3.3600 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -4.2790 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 -4.7660 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -4.1270 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -1.8280 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0560 -4.0820 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0360 -3.6020 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 -1.8410 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8910 -2.4950 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3180 -0.1090 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 0.3590 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -1.0100 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -1.7000 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 0.0520 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.8260 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -0.3890 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 1.2020 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 -0.3700 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7760 1.1500 4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 0.7110 4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -3.5090 5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -1.8980 5.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -2.0850 5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -2.3340 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -0.5760 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -1.4310 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -1.5960 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -2.8180 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.2870 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -2.0530 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7830 -0.3620 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9940 -1.5530 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.5420 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -3.2580 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -2.2390 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 0.9200 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 2.1960 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 0.5370 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 3.7730 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 48 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 49 1 0 0 0 0 12 30 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 60 1 0 0 0 0 22 26 1 0 0 0 0 22 61 1 0 0 0 0 23 34 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 37 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 33 85 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 35 88 1 0 0 0 0 37 89 1 0 0 0 0 M END > 183 $$$$ 184 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 87 0 0 1 0 0 0 0 0999 V2000 -0.0840 1.2380 -0.0790 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6110 -0.7500 -2.6470 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5020 -1.7670 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7120 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.2720 -0.1920 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4630 -0.3160 -0.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4160 1.1370 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 1.8910 0.1500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1640 -1.0650 -0.3160 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2640 -1.8790 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -2.8510 -1.3610 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3270 -3.0690 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -2.3230 0.5640 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9390 1.6160 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 1.1620 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 1.5900 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 0.7470 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -0.3900 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 2.7270 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 1.9430 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -3.0940 0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -4.1630 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -5.0100 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -4.4460 2.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -4.0880 -2.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -5.0030 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -6.3110 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -7.1670 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -8.4950 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -4.7790 -1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -1.1790 -3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -0.7740 -4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -1.1780 -5.8640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2100 -0.5880 -7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -0.8940 -8.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -0.0840 -5.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -2.7040 -5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.6100 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 2.1060 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -0.3950 1.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -2.0660 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 0.2100 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.4000 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -0.1270 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -1.7470 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -0.8160 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.6260 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 1.1570 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 2.8920 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -2.4100 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.1260 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 2.6970 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.6150 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 0.0770 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 1.0540 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -1.0090 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -0.6970 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 3.0340 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 3.3460 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 1.5660 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 3.0160 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 1.7520 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -4.6030 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -6.0310 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -5.0080 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -6.8400 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -6.1180 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -6.6370 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -7.3600 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -9.0240 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -8.3010 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -9.1040 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -0.8040 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 0.4910 -7.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -1.0300 -7.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -0.4730 -9.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -1.9730 -8.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -0.4520 -7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -3.0780 -6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -3.1250 -4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -2.9970 -6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 2.5480 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 2.7750 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 1.1480 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 0.0650 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 14 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 2 42 1 0 0 0 0 3 10 2 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 9 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 40 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 39 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 13 21 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 2 0 0 0 0 17 55 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 29 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 36 2 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 33 73 1 0 0 0 0 34 35 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 37 79 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 40 85 1 0 0 0 0 M END > 184 $$$$ 185 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 0.2220 1.1540 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.3700 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.8440 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 1.7010 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 1.3040 1.2610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9650 -0.2070 1.4420 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7880 -0.2310 3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.7170 1.4420 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9880 1.2260 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 2.0460 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 3.6350 1.3140 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6710 3.1930 0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6430 4.1880 -0.3260 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9610 5.5210 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 5.1450 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 5.9530 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 7.2910 2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -0.6010 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.3720 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -0.5990 2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 2.0700 2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 3.2410 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 4.0100 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 8.0590 3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 9.5540 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 7.5520 4.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 1.4640 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.5500 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -0.7710 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -0.7470 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 1.2970 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.7880 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -0.6390 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -0.8520 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -0.3940 4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 1.2690 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 1.6640 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 3.1020 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 3.1850 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 4.1540 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 6.2980 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 5.8350 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 5.5520 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.1230 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -0.9750 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.4680 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -2.5830 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -2.7630 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8470 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.0960 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -1.6780 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.9290 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 1.6970 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 3.1310 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 3.6180 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 3.6690 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 3.1580 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 9.9530 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 10.0040 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 9.7850 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 21 1 0 0 0 0 6 20 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 22 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 24 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 M END > 185 $$$$ 186 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.2870 0.7840 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.5560 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -1.0300 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.1660 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 1.1750 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.6490 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.1070 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -1.7370 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 -1.8530 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 -2.2050 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -1.0130 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -2.4860 0.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4700 3.1050 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -3.4550 -0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -3.3160 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -2.8290 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -4.2360 2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -4.7010 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -6.1510 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -3.9580 4.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -2.0890 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.2500 0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -1.2280 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 1.8480 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -2.7950 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2600 -1.8250 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -1.0230 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -2.6690 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 3.2490 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 3.4150 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 3.7030 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -2.8140 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -4.1120 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -2.2240 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.6240 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -6.6600 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -6.2210 3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -6.6210 4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -2.6210 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.0380 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -2.5250 -4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 1.5620 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 22 1 0 0 0 0 11 29 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 M END > 186 $$$$ 187 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0830 2.4540 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 1.1620 1.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 0.5300 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 1.4190 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.6590 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 5.0840 -3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 4.0000 -3.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 4.5660 -4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 5.9850 -4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 6.9510 -4.3620 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8800 4.5280 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 5.4970 -2.4540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1380 6.9160 -2.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9820 7.8810 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 7.9280 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 5.4550 -0.9440 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4570 6.5150 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 3.9610 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 8.3690 -4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 6.5380 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 6.7430 -6.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 6.4280 -7.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 5.9950 -6.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 6.6130 -8.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 4.0770 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 6.2190 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 3.1990 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -0.5140 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 1.2230 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 5.7580 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 4.2810 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 3.8720 -4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 6.2750 -4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 6.0160 -5.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 3.5170 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 4.8170 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 7.2260 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 8.8780 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 7.5400 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 8.3480 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 8.5410 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 5.6510 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 4.7910 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 3.9890 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 8.3960 -5.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 9.0590 -4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 8.6640 -4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 5.4860 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 7.1440 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 5.7010 -9.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 6.8320 -9.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 7.4420 -9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 3.9520 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 3.3040 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 7.0030 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 5.1900 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 42 1 0 0 0 0 17 26 2 0 0 0 0 18 25 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 M END > 187 $$$$ 188 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 89 0 0 1 0 0 0 0 0999 V2000 2.8980 3.4980 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 2.2420 0.5490 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3410 1.1950 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 3.1380 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 2.1860 1.9120 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8270 0.9400 1.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1760 -0.0870 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -0.5640 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 1.7270 1.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5760 0.6230 2.7020 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6260 2.4250 1.5420 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1570 2.8710 1.7600 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8220 0.9160 1.3770 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9980 0.1800 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 -0.8780 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8560 -1.2900 2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2810 0.5260 1.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8000 -0.1300 2.5830 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2120 -0.6590 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1360 0.4790 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6160 1.1770 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1810 1.6680 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 2.5930 0.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 2.9450 3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6340 1.1010 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 0.8400 3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5090 2.3940 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 2.9270 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 1.5940 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.1120 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 3.3020 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 2.9270 -1.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 3.1100 0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 0.5340 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6860 0.2320 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2240 -2.4370 2.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 4.1950 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 3.9930 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 1.8110 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 2.6400 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 4.0400 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 0.4750 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 0.3300 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.9590 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -1.2990 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -1.0220 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 1.2950 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4220 2.9710 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 3.7190 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8200 -1.4240 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 -0.2460 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5900 -1.0900 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1940 -1.4410 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2420 1.2060 2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1280 0.0650 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8120 2.0810 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1800 2.4670 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 3.5130 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 2.2380 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 3.6270 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 0.3560 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 2.0470 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 1.2390 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1030 0.3200 4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4570 1.6710 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 1.2200 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5350 2.0630 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1510 2.9050 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4740 3.0790 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.6590 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 0.8460 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 2.5630 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.4120 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.8990 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 0.0550 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 4.3770 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 3.0290 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 2.7730 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 0.9320 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 -0.5520 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 0.9500 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0750 -0.6500 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3120 0.7430 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7200 -0.0710 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 48 1 0 0 0 0 12 33 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 36 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 35 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 28 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 31 1 0 0 0 0 28 32 2 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 M END > 188 $$$$ 189 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 93 0 0 1 0 0 0 0 0999 V2000 1.7070 3.3750 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 2.3320 -0.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5710 1.1380 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 2.7460 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 1.6330 1.5790 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8850 0.5980 0.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7140 -0.5820 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -1.2900 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 0.9500 1.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1040 -0.3260 2.6470 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5770 1.2040 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 1.8950 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -0.0630 3.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4940 -0.9910 2.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3680 -2.3440 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 -3.0140 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8640 -0.7490 3.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6910 -2.1160 4.2000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0170 -2.8510 4.3420 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3250 -2.0770 4.3090 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3020 -0.5870 3.9820 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9150 -0.0110 4.3320 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4790 2.9370 -0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 2.2850 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -0.0560 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -1.9350 5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3600 0.1360 4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 3.5000 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 -0.3870 2.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -1.2680 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.5050 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 0.0400 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 4.1460 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 3.4890 -2.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9110 -2.9510 3.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 1.4930 4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 4.1810 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 3.8140 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.9750 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 2.3120 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 3.5040 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 0.1870 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.2610 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.3030 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -2.1470 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -1.6320 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 0.6970 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 0.9910 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 1.9730 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 2.7880 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 2.2000 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 0.2260 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -2.2650 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -2.9820 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6450 -3.9720 3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -3.2040 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 -0.9400 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -3.7080 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1300 -2.4120 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 -0.1980 5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 2.9340 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 1.5120 3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 2.8750 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.9590 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 0.7490 4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 0.2340 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -2.9080 6.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7670 -1.2970 6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -1.4720 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3440 -0.2700 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3420 1.2000 4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1480 -0.0060 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -0.7250 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -0.3280 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 -1.7380 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 -1.9320 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 1.6730 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.6920 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 2.4140 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.2260 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -0.8410 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 0.4140 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 4.0590 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 5.2000 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 3.6480 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 1.9530 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 1.8790 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2430 1.7290 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 29 1 0 0 0 0 22 36 1 0 0 0 0 22 60 1 0 0 0 0 23 28 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 33 1 0 0 0 0 28 34 2 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 33 85 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 36 88 1 0 0 0 0 M END > 189 $$$$ 190 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 90 0 0 1 0 0 0 0 0999 V2000 1.6980 3.3590 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 2.0640 -0.0320 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3310 1.0030 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 3.0980 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 2.1870 1.6840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8220 0.9120 1.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1130 -0.0980 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -0.3980 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 1.9600 1.7330 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3830 0.9550 2.6680 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3210 2.9760 1.9370 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8120 3.2160 1.8510 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7450 1.5770 1.7500 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9350 0.7050 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 -0.2510 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -0.4950 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2880 1.3420 1.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5840 0.8040 3.4400 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0840 0.6520 3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9080 1.8910 3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5610 2.4460 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0170 2.6440 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 2.2770 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 2.9650 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 1.3590 4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1230 1.7250 4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2960 3.7970 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 2.6450 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 1.2290 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.3200 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 2.8840 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 2.7840 -2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 3.5340 0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 1.0830 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0220 1.4670 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 4.0880 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 3.8710 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 1.6300 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 2.6740 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 4.0740 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 0.4630 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.2450 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -1.0420 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -1.0870 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -0.8380 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 1.5030 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9490 3.6000 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 4.0440 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 -0.8990 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 -0.9440 4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 -1.2280 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5820 0.6190 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3400 0.2090 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4290 -0.1780 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6360 2.5950 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9340 1.6630 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 3.0040 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 3.4660 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 3.4540 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 2.2870 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 3.7180 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 0.6640 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 2.3700 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 1.3220 4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3230 1.2900 5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 2.6730 4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 1.8940 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3730 3.6370 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0460 4.2090 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 4.4940 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 1.1770 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 0.4610 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 2.2110 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -0.4950 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -1.1450 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.2520 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 3.6820 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 3.1720 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 1.9700 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 1.6000 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 0.0100 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 1.2890 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5240 0.5070 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7650 1.8790 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1020 1.3280 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 46 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 47 1 0 0 0 0 12 33 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 35 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 28 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 31 1 0 0 0 0 28 32 2 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 M END > 190 $$$$ 191 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0270 1.5000 -0.0080 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0120 0.0160 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 0.0380 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.6840 1.1600 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1200 -0.5410 1.1980 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6180 -1.9530 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.8060 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -2.1190 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.9670 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -3.9710 1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 1.5590 -0.0530 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2510 2.2660 -0.0120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0740 2.2580 -1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 3.5890 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 4.2160 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 5.6020 1.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9450 6.1770 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 6.4800 0.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 7.4560 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 8.4070 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 7.5730 2.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 -2.3440 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.8010 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.3280 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.2990 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -0.2800 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.3220 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.2860 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.0940 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 1.5020 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 3.0510 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.6820 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 2.0380 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 4.2680 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 3.4050 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 3.5830 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 4.3100 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 5.5180 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 7.1640 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 5.5180 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 6.2600 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 8.0070 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 9.3750 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 8.5290 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -1.6170 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -3.3890 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 22 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 M END > 191 $$$$ 192 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 85 0 0 1 0 0 0 0 0999 V2000 0.4500 2.5990 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.1450 0.1970 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4460 0.3500 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 2.6400 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 1.8400 1.6560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9720 0.3920 1.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3840 -0.3620 2.8080 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8640 -0.2170 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 1.9140 1.7540 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5480 0.7840 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 3.3340 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 3.2760 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 2.2370 3.5410 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0270 0.8760 2.8170 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5950 -0.0980 3.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8790 0.6300 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 2.1410 4.0700 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4290 1.0980 0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 2.4610 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -0.2140 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 1.8400 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 2.3200 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 2.9380 5.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1680 2.7240 5.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5860 4.4260 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3050 2.2020 7.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 1.9890 7.7130 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8210 2.7860 9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2180 2.5690 9.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8870 0.5010 8.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6150 4.2740 8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 0.1920 3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 0.8400 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.6440 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.1400 6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -1.8010 4.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 2.5040 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 3.1730 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 3.0260 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 0.7130 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.7840 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.6850 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 2.2070 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 3.6740 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -1.4170 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -0.9840 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 3.1730 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 4.3040 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 4.0450 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 3.4730 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -0.2400 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -1.0520 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 0.4580 5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7460 0.2760 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 1.5870 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 2.2570 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 2.0290 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 3.5380 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -1.1390 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 2.2280 4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 1.5120 5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 3.2790 5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 2.6010 6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 3.0020 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 4.5950 4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7830 5.0040 5.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 4.7400 4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 1.9250 7.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4310 2.3260 6.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0710 2.4490 9.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9680 2.9060 8.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3170 3.1370 10.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3640 1.5090 9.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7880 -0.0680 7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8820 0.3460 8.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1370 0.1630 8.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 4.4290 8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7140 4.8420 9.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3650 4.6110 8.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 0.9190 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.6970 6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -0.2780 7.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 45 1 0 0 0 0 8 10 2 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 21 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 23 1 0 0 0 0 17 37 1 0 0 0 0 18 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 63 1 0 0 0 0 24 26 2 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 69 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 M END > 192 $$$$ 193 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -0.1560 1.0490 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.4660 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.1640 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 1.5520 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 0.9330 1.6360 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9940 -0.5820 1.5630 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8290 -1.1800 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -0.9290 2.3310 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5300 1.3460 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 0.4970 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.1830 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 2.7370 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 2.3170 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 0.9510 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 1.4790 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -1.1230 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.8690 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -2.6500 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.5450 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 0.1740 2.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 2.7530 1.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3660 2.6070 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 1.8790 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 2.3730 0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -1.8110 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -3.0760 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -3.8920 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 4.4520 0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5700 1.7120 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1370 0.7520 -1.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 2.1660 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5060 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 1.3430 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.8120 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.7340 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 1.2770 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 2.6380 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -0.7250 3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -2.2570 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -1.1330 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 1.3340 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 0.9490 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 2.5420 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -1.7340 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.5130 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -0.0940 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.7170 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -3.1960 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -3.0830 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 3.7950 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 1.5640 2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 2.9220 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 3.2290 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 0.8500 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 1.9140 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9200 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -3.6160 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -4.8570 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -4.0470 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -3.3520 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 4.9930 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5420 2.1260 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4620 1.5120 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9830 3.1890 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 28 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 20 2 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 M END > 193 $$$$ 194 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.4820 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 2.0580 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1370 1.6250 1.2760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2380 0.1000 1.3150 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8250 -0.3500 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.2680 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -1.3740 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -0.2460 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 2.1020 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 3.5080 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 1.9500 2.6920 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0960 0.4400 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 0.0400 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 1.1910 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 2.3000 2.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4100 1.1500 3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.3750 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 4.0570 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 5.5560 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 3.3480 -2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8890 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8790 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.3840 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -0.3590 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 1.6600 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -0.1320 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -1.4160 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 1.8610 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 3.3480 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.7790 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -1.7040 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 1.6610 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 1.7980 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 3.1890 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 2.4380 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 -1.9000 2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 -1.3620 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -1.8850 3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 6.0220 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 5.8780 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 5.8500 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 9 2 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 14 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END > 194 $$$$ 195 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.3760 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0060 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.6820 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0210 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4070 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0870 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -2.1890 -0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1570 3.4470 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 2.1000 0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.3360 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.7030 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -3.5470 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -2.6800 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -3.8530 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -4.4500 -1.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -4.4250 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 4.0650 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 5.5640 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 3.4190 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 1.9010 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.5590 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.5090 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -2.5390 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 0.7020 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.7130 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 2.0100 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -2.3740 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -3.8750 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -3.9150 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -3.7510 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -4.5410 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -5.3980 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 5.9700 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 5.9830 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 5.8250 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 8 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 M END > 195 $$$$ 196 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 47 0 0 1 0 0 0 0 0999 V2000 -5.2500 -10.2280 4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -9.9890 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -10.4990 4.9040 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9910 -9.3770 5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -11.1060 3.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -8.4820 5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -7.4320 5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -6.5370 5.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -5.4150 5.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7570 -5.9250 5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -5.6690 6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -4.7370 7.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -5.4960 8.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -4.5860 9.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -5.3800 11.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -4.4700 12.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -5.2640 13.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -4.3530 14.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -4.4330 4.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -3.1430 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -2.8480 5.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.0620 3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -10.7910 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -9.8660 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -9.4270 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -11.2360 5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -10.5060 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -4.9520 6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -6.5020 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -6.1270 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -3.9070 7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -4.3530 7.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -6.3770 8.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -5.8050 8.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -3.7500 9.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -4.2060 9.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -6.2160 10.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -5.7590 11.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -3.6340 12.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -4.0900 11.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -6.1000 13.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -5.6430 13.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -3.5170 14.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -3.9740 14.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -4.9200 15.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.5100 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -1.3620 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -1.5300 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 4 6 3 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 3 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 M END > 196 $$$$ 197 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 95 0 0 1 0 0 0 0 0999 V2000 -0.1210 2.6490 1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 1.3720 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 0.6300 1.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 1.6050 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 2.4640 -5.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0540 3.9410 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 2.1120 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 3.5300 -2.6310 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1120 4.4110 -3.5490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5590 5.8680 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 6.3610 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 4.0520 -1.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0540 5.5500 -1.0430 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0670 3.4830 1.1930 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7220 3.3350 -0.1870 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3080 2.0160 -6.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 3.4640 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 4.2060 -5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 4.7290 -5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 7.4500 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 7.7340 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 5.3680 2.9330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6990 6.7130 2.9330 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9400 7.2000 4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 7.3100 5.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 5.9240 5.1610 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3170 5.4410 3.7330 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6250 5.9700 0.3790 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6900 4.9370 1.4870 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6750 5.3750 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 5.9340 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 6.5580 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 4.0540 3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 6.0020 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 1.0670 -6.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 0.5540 -8.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 0.6240 -6.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 1.9400 -0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 4.6210 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.0070 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.5730 -4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 1.5810 -4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 2.3540 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 2.1490 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 1.4140 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 4.3970 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 5.9710 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 6.4830 -4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 7.4170 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 6.2320 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 3.8520 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 3.1320 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 3.7620 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 2.9410 -4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 4.4750 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 2.9280 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 4.0640 -6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 5.2300 -5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 3.5140 -5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 4.5320 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 5.7960 -5.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 4.4130 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 8.0270 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 7.8120 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 8.7380 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 7.7040 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 6.4920 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 8.1780 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 7.6670 6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 8.0020 4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 5.2230 5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 6.1310 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 6.0360 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 4.6800 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 6.9680 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 5.2790 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 5.8260 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 7.5180 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 5.8270 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 6.2180 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 3.3660 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 4.1190 4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 3.6900 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 6.6980 5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 5.0140 5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 6.3500 6.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.0670 -8.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -0.5180 -8.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 0.7410 -8.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 1.4720 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 43 1 0 0 0 0 6 9 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 51 1 0 0 0 0 13 28 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 52 1 0 0 0 0 15 38 1 0 0 0 0 15 53 1 0 0 0 0 16 35 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 21 23 1 0 0 0 0 21 65 1 0 0 0 0 21 66 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 29 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 26 71 1 0 0 0 0 27 33 1 0 0 0 0 27 72 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 30 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 34 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 87 1 0 0 0 0 36 88 1 0 0 0 0 36 89 1 0 0 0 0 38 90 1 0 0 0 0 M END > 197 $$$$ 198 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1860 1.3340 -0.5570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1600 -0.1520 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.5860 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 0.5000 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.7790 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 5.0920 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 4.7170 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 3.3440 -1.2340 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8610 4.0880 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 2.6750 0.7200 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0320 2.2920 -0.6510 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7860 2.0400 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 1.7020 0.8690 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1760 2.5590 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 0.9770 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 3.4270 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -0.8530 -0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 2.9930 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 0.5100 1.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.1280 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 0.2940 2.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -1.3730 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 0.3270 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 0.5720 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 6.0950 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 5.0580 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 5.4570 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 4.6750 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 3.0600 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 4.1010 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 4.3720 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.9830 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 1.3920 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 2.1960 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 0.5780 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 0.2590 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 1.1580 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 4.1600 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 2.4510 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 3.7290 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 3.1570 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 3.8310 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -2.1330 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.7470 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -1.1370 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 17 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 18 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 19 1 0 0 0 0 13 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 M END > 198 $$$$ 199 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.5320 1.2250 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9980 2.5660 1.3200 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0600 -0.8270 2.4890 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5680 -0.5730 2.4430 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1020 2.5160 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 2.3560 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -1.8640 1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.0150 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.8330 2.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -1.9310 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.9940 1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -3.2090 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 3.4460 0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 1.6780 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 0.3480 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -0.0200 4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 1.1070 5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 2.1320 4.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.4090 5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.3690 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.3540 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 1.5670 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -0.6560 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.1120 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.5270 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 2.0770 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 2.8600 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 2.7680 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 1.2890 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 0.1240 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -0.7380 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 0.9370 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -3.9340 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -3.6120 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -3.0050 2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 1.1750 6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 -1.5920 4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.4990 6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -2.1390 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 27 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 28 1 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 7 29 1 0 0 0 0 8 17 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 199 $$$$ 200 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 72 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3400 1.9820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 1.5270 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 0.3550 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8430 -0.4110 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.4360 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -1.8380 1.1490 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3810 -0.6090 0.2840 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4290 -0.3860 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 2.0160 -1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -1.0420 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -3.0040 0.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -0.1480 2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 0.8120 2.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 3.3420 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 3.9230 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 5.4430 -2.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5080 4.0690 -0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 6.0410 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 6.0200 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -4.2050 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -5.4600 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -4.2790 2.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 0.5120 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 1.4610 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -0.5190 4.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.3010 1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 7.5230 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -6.6820 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -7.9490 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -6.7630 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -1.7530 -0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -2.2030 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -2.9510 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -2.0090 -2.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.8850 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 2.1270 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.9240 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -2.0360 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -0.1610 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0 0 0 -2.0910 -6.5910 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -8.0400 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -8.8200 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -7.8920 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -6.8540 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -5.8600 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -7.6330 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -2.2450 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 -3.6640 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -3.4850 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 40 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 11 16 1 0 0 0 0 12 33 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 18 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 29 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 30 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 M END > 200 $$$$ 201 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.2400 2.2400 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 0.7270 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.0010 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.6860 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 2.0560 -1.4710 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9660 0.5380 -1.3740 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8970 -0.1370 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 0.1440 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 2.4250 -1.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5910 1.6400 -1.9380 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7580 2.1560 -3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 3.5220 -3.0860 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3500 4.4330 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 3.9180 -1.1830 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5820 -1.4830 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.0380 -2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 0.2660 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 2.6100 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 3.1680 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 1.9680 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 3.8220 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 1.3500 -0.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 4.2410 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 4.0610 -2.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 4.7100 -3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 4.0860 -4.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 6.2170 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0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 23 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 18 24 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 M END > 201 $$$$ 202 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 4.2570 5.7760 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 4.9280 0.6040 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9480 3.6200 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 4.9920 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 3.7430 2.2250 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2580 2.9000 1.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0950 1.5970 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 0.7740 2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 2.9310 2.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5760 1.5380 2.7700 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1430 2.9360 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 3.6980 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0610 1.5220 3.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8750 0.7720 2.4590 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7810 -0.6610 2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 -1.4230 2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3320 0.7220 2.8050 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2100 -0.6400 3.4940 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6190 -1.2170 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5500 -0.0100 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6470 1.2360 3.4220 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9310 5.6770 0.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 3.8820 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 4.2150 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9290 -0.5100 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 1.5840 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 0.6820 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 2.7340 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 6.4380 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 7.2430 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 6.4790 -1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2560 2.3590 2.5720 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4580 1.8620 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5170 2.7440 3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8640 4.1530 2.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5840 3.2170 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5240 1.5550 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 6.6710 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 6.1060 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 4.6880 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 4.6750 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 5.6170 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 2.6000 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 1.7800 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 1.0140 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -0.1740 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 0.5840 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 2.8330 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 2.9160 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 3.4810 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9120 4.6820 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 3.8320 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 1.6280 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -0.6820 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 -1.1850 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -2.4120 3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3210 -1.5510 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4880 0.5820 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8540 -1.8840 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6840 -1.7500 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2200 -0.0510 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1240 0.0280 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 4.2030 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 2.9670 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 4.6620 3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 5.0150 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 3.3820 4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 4.5850 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8530 -1.5030 5.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7400 0.0400 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 0.0260 5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 0.5800 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 2.2410 4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 1.9620 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 1.6860 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9730 0.1400 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 0.1540 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 2.5530 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.7840 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 3.2430 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 7.0800 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 8.3020 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 6.9290 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5200 1.4540 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 2.6920 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2220 1.0850 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7170 4.4140 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 48 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 18 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 32 1 0 0 0 0 21 37 1 0 0 0 0 22 29 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 27 75 1 0 0 0 0 27 76 1 0 0 0 0 27 77 1 0 0 0 0 28 78 1 0 0 0 0 28 79 1 0 0 0 0 28 80 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 81 1 0 0 0 0 30 82 1 0 0 0 0 30 83 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 36 1 0 0 0 0 33 84 1 0 0 0 0 33 85 1 0 0 0 0 33 86 1 0 0 0 0 34 35 1 0 0 0 0 35 87 1 0 0 0 0 M END > 202 $$$$ 203 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 1.1380 2.6990 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 1.4210 -0.2620 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5860 0.3020 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 2.4230 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 1.3990 1.6080 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0280 0.1220 1.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1990 -0.9320 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -1.3280 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 1.0690 1.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5550 -0.1210 2.6490 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4740 1.9820 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 2.2440 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 0.7350 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -0.4770 2.5490 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4090 -1.5500 3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9210 -1.7350 3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 1.0600 3.4500 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 3.1000 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 1.0900 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 2.0160 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 3.3460 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -0.2710 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -0.5680 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -1.8280 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -2.0920 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -1.7590 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 0.8450 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 2.8200 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -1.3940 4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 -2.5110 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1230 -2.4610 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3390 -2.1110 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 0.4380 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -0.1990 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.5390 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 2.5360 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 1.2390 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 2.7350 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -0.5350 6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 1.1140 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 0.3300 5.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -0.5480 4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 1.1570 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 0.5000 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 -0.3500 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 -1.3460 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -1.9740 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.1820 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -1.8360 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.8890 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 3.4380 -1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 2.1770 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 1.7630 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1790 -1.2980 5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5470 -1.0600 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3520 1.1040 5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8110 0.5500 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0310 2.5000 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5190 2.4290 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 3.0640 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 3.8850 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4050 3.3830 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1390 0.4340 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2640 2.1650 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4590 1.4120 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2280 0.3800 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 48 1 0 0 0 0 10 14 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 49 1 0 0 0 0 12 33 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 28 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 24 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 28 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 72 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 36 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 31 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 35 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 36 37 1 0 0 0 0 37 87 1 0 0 0 0 M END > 203 $$$$ 204 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 89 93 0 0 1 0 0 0 0 0999 V2000 1.0140 1.0690 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -0.2190 0.4910 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5740 -1.3320 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 0.8420 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -0.2020 2.1450 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0550 -1.4810 1.7900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3510 -2.5730 2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -2.9360 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -0.5230 2.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6990 -1.7130 3.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6380 0.2770 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 0.6950 2.4600 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0520 -0.9070 3.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1760 -2.0820 2.7720 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5470 -3.3480 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 -3.6530 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5290 -1.2410 3.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8770 -2.4670 3.8970 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3580 -2.8150 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2280 -1.6240 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9070 -0.4110 3.2460 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4260 -0.0460 3.3200 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1100 0.0100 0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -1.1000 2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 0.4020 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 0.6930 4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5810 -2.2790 5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 -1.4070 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 1.7220 1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -2.3370 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3190 -0.6620 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.6390 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 0.4130 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 0.6710 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 0.5700 -1.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 3.0840 1.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 0.8690 1.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 1.8310 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 1.4450 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.5370 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 0.5030 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 1.7960 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -1.8380 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 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0 0 1.3850 0.8510 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -0.3790 4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 1.1680 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3210 0.0380 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 1.5810 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0710 0.9880 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 -3.2340 5.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 -1.5580 5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 -1.9120 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -2.1950 5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -0.4510 4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -1.3570 4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 -1.4370 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -2.5990 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -3.1570 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 -1.5250 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0820 0.2160 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3910 -0.8550 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -2.8220 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -3.4730 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -2.5440 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 0.4780 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 1.7090 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 0.0120 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 3.7780 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 48 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 2 0 0 0 0 12 29 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 60 1 0 0 0 0 22 26 1 0 0 0 0 22 61 1 0 0 0 0 23 33 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 28 76 1 0 0 0 0 29 36 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 32 85 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 86 1 0 0 0 0 34 87 1 0 0 0 0 34 88 1 0 0 0 0 36 89 1 0 0 0 0 M END > 204 $$$$ 205 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6620 -0.5130 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 2.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 1.6130 1.2760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0370 0.1220 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -0.6550 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -0.1430 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 2.1270 1.2750 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4300 1.3040 2.2390 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0120 4.1610 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 3.6120 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 3.3370 2.7630 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8280 1.8890 2.2110 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8620 1.2280 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 2.3720 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 3.6800 2.9620 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3580 -0.5060 -0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 2.2420 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 3.3640 4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 4.7670 3.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 1.3410 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -1.6850 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -2.2690 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -2.2780 -1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 2.0160 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 1.9070 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.8860 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.8760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.3550 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.2330 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -1.5980 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 1.6720 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 3.1500 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -1.7180 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -0.7620 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -0.1770 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 4.0620 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 5.2080 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 4.1640 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 3.7540 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 0.7800 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 0.4720 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 2.4370 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 2.1990 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 3.9110 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 1.9080 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 1.9370 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 3.3280 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.9380 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 2.7780 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 4.3930 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2900 4.9740 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -1.5980 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -2.3940 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -3.2380 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 21 1 0 0 0 0 17 46 1 0 0 0 0 18 23 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 M END > 205 $$$$ 206 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 0.0110 1.7650 0.4910 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0270 0.3040 0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.1180 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.9820 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 2.1860 0.5350 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9020 5.0250 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 3.9100 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 3.1810 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 4.6010 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 5.0960 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 2.3610 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 3.4760 1.3160 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9880 4.6230 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 6.1640 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 3.4030 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 3.1600 0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.2810 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 0.9310 1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 3.3250 2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 4.0370 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 3.9330 4.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 4.7650 3.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 3.1410 5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 4.5380 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 3.1900 6.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 5.4330 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 6.6520 3.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 7.5620 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 7.3470 1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 8.8520 2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 2.1050 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 2.3080 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 5.1890 -3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 5.9450 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 4.3440 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 3.2220 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 3.8710 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 2.0930 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 3.7000 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 4.2770 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 5.4520 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 5.8130 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 6.3840 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 7.0680 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 2.7200 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 4.4320 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 3.2850 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -0.0010 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 1.8220 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 3.5680 6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 2.1060 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 4.3880 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 2.7010 7.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 4.9170 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 5.6810 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 8.8670 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 8.9300 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 9.6930 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 17 2 0 0 0 0 4 5 1 0 0 0 0 4 18 2 0 0 0 0 5 12 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 11 2 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 24 2 0 0 0 0 23 25 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 26 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END > 206 $$$$ 207 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 76 0 0 1 0 0 0 0 0999 V2000 0.3210 0.7660 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -2.6770 -0.4080 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0170 -3.4360 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -4.8420 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -5.7500 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -5.4040 -0.3740 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3800 -3.0170 -1.1040 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4780 -4.4660 -1.5590 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6910 -4.4510 -2.5060 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5400 -3.1040 -3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -2.1930 -2.3600 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4580 -1.8520 -3.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -4.8470 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -6.6090 -0.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -4.4790 -1.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 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1.6070 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 0.4900 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -2.9690 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.9180 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -3.4800 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -6.7530 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -4.9060 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -5.2880 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -3.2650 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -2.6530 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.3610 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -5.8750 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -4.1800 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.7560 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -0.3010 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -0.7780 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 0.7500 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 0.1220 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -2.0350 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -1.7500 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -0.4210 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -5.5760 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -5.9730 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -4.3180 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -4.6570 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -4.6230 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 -6.1800 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -8.7010 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 -10.7510 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -11.6700 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -10.5450 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -8.4900 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 2.3900 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 1.6290 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 2.6210 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 1.1780 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -0.2860 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 0.0270 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 1.1220 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 35 2 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 27 1 0 0 0 0 15 24 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 16 50 1 0 0 0 0 18 21 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 2 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 32 33 2 0 0 0 0 32 65 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 34 67 1 0 0 0 0 35 37 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 M END > 207 $$$$ 208 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 78 80 0 0 1 0 0 0 0 0999 V2000 0.6820 0.8020 -0.0370 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8890 -0.6010 -0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -1.3060 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -0.7430 -1.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.7470 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -3.4510 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -4.9020 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -5.6360 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -6.9940 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -7.6310 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -6.9120 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -5.5520 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 0.5860 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -0.4380 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -0.8760 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -1.0080 -2.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 7.6280 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.8720 0.4220 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2790 3.4110 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 2.2750 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 1.0790 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 2.9730 -0.6010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0090 1.5380 -0.1300 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9600 0.9540 -1.1890 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9340 2.1240 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 3.4220 -1.0790 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8930 4.0810 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 1.5340 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 4.3510 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.9470 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 5.2400 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 4.7310 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 3.6350 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 6.2200 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 5.9380 2.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 2.5320 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 8.5950 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 7.9760 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 8.2460 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.1730 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -3.2470 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -2.9510 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -5.1400 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -7.5620 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -8.6950 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -7.4160 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -4.9920 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.0480 -5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -1.7140 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -1.1840 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 3.8190 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 4.2430 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 3.0710 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.2820 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.0960 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 2.0120 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 2.1490 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 4.3550 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 0.5050 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 2.0520 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 2.0420 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 5.2520 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 5.3930 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 5.2410 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 3.8300 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 3.4770 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 4.2460 -4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 2.6730 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 2.3430 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.8700 3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 3.5690 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 9.6290 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 8.0780 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 8.9170 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 7.1860 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 7.6780 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 7.6470 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 9.1620 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 23 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 17 34 1 0 0 0 0 17 37 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 31 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 29 62 1 0 0 0 0 31 34 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 34 35 2 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 39 1 0 0 0 0 37 72 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 M END > 208 $$$$ 209 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.2250 1.3470 -0.2150 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6640 1.8080 -0.3060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5710 0.7950 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.9230 -1.3960 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1120 -0.2250 -0.1950 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3900 -0.6720 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -1.7480 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -1.3430 -2.3020 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0780 -0.0990 -0.7880 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0970 -0.8800 -1.7130 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1290 -1.6090 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.3240 -3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.5990 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -1.9360 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -2.2080 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -2.3590 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 1.9910 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.8200 1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 3.0970 0.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 3.9290 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 3.5930 -1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 5.2820 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 1.9180 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 1.3080 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.2240 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -1.1170 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 0.1420 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -2.7320 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -1.7420 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -2.2600 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 0.4020 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -0.8090 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 0.5270 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.0140 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -0.7810 -3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -1.4140 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -2.6950 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -2.9400 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -3.1470 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -2.8010 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -1.6650 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 1.6400 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 3.0750 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 1.7220 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 2.7820 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 5.2040 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 5.9860 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 5.6350 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 23 1 0 0 0 0 3 9 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 12 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 M END > 209 $$$$ 210 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 61 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 6.4780 7.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 6.2510 6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2250 5.0940 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0110 4.1590 6.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 4.8520 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 4.1070 4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 3.8620 2.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6070 3.2280 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 3.0980 1.4760 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7710 2.3520 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 2.1120 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0240 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -0.6420 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 3.5390 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1130 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0330 5.5440 8.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 4.3790 7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1910 3.4600 8.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 2.2890 7.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4290 5.7650 9.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 4.3990 0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 3.1110 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 2.2180 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 3.9570 0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 2.9670 2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7620 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 7.3800 8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 6.9800 5.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3090 3.2560 5.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 4.2530 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 5.8080 3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 4.7060 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 3.1520 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 4.8100 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 3.8580 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 2.2410 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 2.5430 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.9500 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.3950 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 3.0690 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 1.5140 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.8300 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 3.8710 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 3.8620 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 3.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6440 1.7570 7.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1640 1.6410 8.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1080 2.5770 6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2700 6.2350 9.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 4.9500 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 1.5230 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8240 2.8260 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 1.6570 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 17 2 0 0 0 0 3 32 1 0 0 0 0 4 16 2 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 M END > 210 $$$$ 211 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 90 0 0 1 0 0 0 0 0999 V2000 1.7210 3.2800 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 2.2190 -0.4810 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5980 1.0440 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 2.6650 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 1.5690 1.5810 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9160 0.5180 1.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7470 -0.6330 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -1.3310 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 0.9020 1.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1410 -0.3520 2.7010 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3620 1.4170 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 1.8650 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.8100 -0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 2.2340 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.4340 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.0740 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -2.4020 3.2680 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0440 -2.7610 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 -0.4660 3.4610 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7120 -1.6120 4.4250 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0050 -2.0990 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0170 -2.5200 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3380 -1.3090 3.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0600 -0.8490 2.4370 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5380 -1.0260 2.6250 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7100 -0.0490 2.7450 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4060 -0.7370 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -0.0410 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 -1.1130 5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 0.3680 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3860 -1.6980 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -3.3740 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 3.3480 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 3.9780 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 3.3250 -2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3610 0.3930 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 4.0750 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 3.7300 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.8440 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.2200 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 3.4340 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 0.0820 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -0.2820 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -1.3660 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -2.1710 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -1.6990 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 0.6130 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 2.1060 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 2.9150 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 2.8710 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 1.4680 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 2.8380 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 1.5880 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 0.6370 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 2.3550 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.3560 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -0.9410 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 0.2900 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -2.4610 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -3.6460 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -3.0110 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4220 -1.2890 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 -2.9460 5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9300 -2.8690 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 -3.3190 3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 -0.4990 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 -1.6560 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -1.5420 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 -0.1300 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -0.9340 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 0.7590 4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 0.2730 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -1.9280 6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 -0.2920 6.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -0.7650 5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 1.1720 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1600 0.0920 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5030 0.7060 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9980 -2.5050 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6140 -0.8350 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2940 -2.0320 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -4.2850 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 5.0360 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 3.8740 -3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 3.4820 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 25 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 13 33 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 32 1 0 0 0 0 17 59 1 0 0 0 0 18 20 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 26 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 66 1 0 0 0 0 24 30 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 27 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 34 85 1 0 0 0 0 M END > 211 $$$$ 212 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 90 0 0 1 0 0 0 0 0999 V2000 1.4620 -1.1590 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -2.2180 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.0220 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -4.1300 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -4.1800 4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -5.2150 5.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -4.5230 6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -2.6350 1.2410 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6610 -6.1940 5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -2.8630 -6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -3.6690 -7.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5150 -4.9140 -6.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -2.4720 -5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -3.7420 -4.4480 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4310 -4.5940 -4.8820 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5470 -5.8280 -3.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -5.3520 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -3.3190 -2.9960 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7710 -4.4560 -2.0350 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7410 -1.8260 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -2.4140 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -2.9890 -0.1740 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1820 -3.8300 -0.6950 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4100 -4.7950 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -3.9730 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -4.0780 -8.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -4.4460 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -5.3400 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -3.5900 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -3.9780 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -2.6720 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -2.9800 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -6.0100 -6.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -5.4290 -6.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -3.2430 -9.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -3.5990 -11.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -2.2060 -9.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -5.9270 4.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -0.5830 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 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0 0 0 0 0 0 0 0 0 2.6000 -1.1730 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -1.2380 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.5890 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -2.9630 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -5.6620 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -5.1050 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -3.8060 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -4.4980 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -4.5480 -5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -5.4340 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -3.8600 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -6.0070 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -4.7090 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -5.9310 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -2.1810 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -2.5480 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -3.6070 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -6.3510 -7.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -6.8470 -6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -5.6150 -6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 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1 0 0 0 0 16 58 1 0 0 0 0 17 19 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 23 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 35 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 38 87 1 0 0 0 0 M END > 212 $$$$ 213 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5300 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.4540 1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 2.0290 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2260 1.2960 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 0.1020 1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -0.5570 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 1.8320 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 1.1810 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -0.0280 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -0.6650 3.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -0.1520 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 1.0530 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 1.7400 2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 -0.7530 5.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 1.7920 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 2.0040 1.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.5380 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.5020 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 3.1760 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 3.7320 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 3.7860 0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8950 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 3.0980 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.4840 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 2.7610 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 1.4290 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 2.6670 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 2.0850 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.1780 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.6280 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -0.1890 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -0.1270 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -1.5920 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.1410 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 3.0480 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 4.7020 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 3.8470 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 10 2 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M END > 213 $$$$ 214 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 149157 0 0 1 0 0 0 0 0999 V2000 0.7370 2.8280 -6.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 1.5970 -7.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.3860 -7.8980 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2960 -0.9600 -7.6150 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3560 0.0210 -8.1250 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1420 1.3830 -7.4580 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8190 1.8450 -7.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.9910 -7.2400 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0900 -1.2600 -7.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -2.2130 -8.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -0.4700 -7.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 2.3190 -7.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 7.1380 -8.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 4.6960 -8.2200 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1350 3.5540 -7.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2200 3.4830 -6.1750 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3130 4.8360 -5.4650 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5920 5.8580 -6.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 6.0030 -7.4310 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7030 4.4200 -8.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 2.4680 -5.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 4.7940 -4.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 6.9650 -4.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 5.9770 -3.6930 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9330 5.5860 -2.2910 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6000 8.1990 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2710 7.7780 -2.1670 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.3400 6.7900 -1.4720 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.8570 6.4330 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 7.7050 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 9.0090 -1.2750 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.8040 8.7340 0.1590 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.7590 11.0380 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1500 10.1390 -1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8010 11.0140 0.3380 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.7740 10.0650 0.9350 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.0810 9.8440 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 11.1840 3.1300 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.8150 12.4050 0.9560 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.3070 12.0410 2.3780 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.7000 13.2940 3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5490 14.2990 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9940 14.5980 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6230 13.3030 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 4.9200 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 4.5270 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6370 7.2020 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2190 8.1520 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 10.6240 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0710 11.8470 3.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0040 15.4060 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 15.4380 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6470 12.9570 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1410 10.5630 0.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4930 11.1290 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 3.7520 -2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 3.0560 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 1.8310 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 3.4110 -0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 0.1330 -12.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3650 0.7010 -12.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5600 -1.6050 -10.5880 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2410 -2.6160 -9.4830 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.5420 -1.8910 -8.3290 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2850 -1.1960 -8.8610 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6490 -0.2920 -9.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -0.9210 -11.0330 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.1470 -2.2840 -11.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 -3.2070 -9.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -2.8360 -7.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 7.3640 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 9.3700 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 3.2700 -7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 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6 79 1 0 0 0 0 7 8 1 0 0 0 0 8 80 1 0 0 0 0 9 81 1 0 0 0 0 10 82 1 0 0 0 0 11 65 1 0 0 0 0 12 15 1 0 0 0 0 13 19 1 0 0 0 0 13 83 1 0 0 0 0 13 84 1 0 0 0 0 13 85 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 14 86 1 0 0 0 0 15 16 1 0 0 0 0 15 87 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 88 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 89 1 0 0 0 0 18 19 1 0 0 0 0 19 90 1 0 0 0 0 20 91 1 0 0 0 0 21 92 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 93 1 0 0 0 0 23 94 1 0 0 0 0 24 25 1 0 0 0 0 24 95 1 0 0 0 0 25 28 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 96 1 0 0 0 0 26 97 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 71 1 0 0 0 0 29 30 1 0 0 0 0 29 98 1 0 0 0 0 29 99 1 0 0 0 0 30 32 1 0 0 0 0 30100 1 0 0 0 0 30101 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 72 1 0 0 0 0 32 36 1 0 0 0 0 32 48 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 33102 1 0 0 0 0 34103 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 54 1 0 0 0 0 36 37 1 0 0 0 0 36 49 1 0 0 0 0 37 38 1 0 0 0 0 37104 1 0 0 0 0 37105 1 0 0 0 0 38 40 1 0 0 0 0 38 50 1 0 0 0 0 38106 1 0 0 0 0 39 40 1 0 0 0 0 39 44 1 0 0 0 0 39 53 1 0 0 0 0 40 41 1 0 0 0 0 40 55 1 0 0 0 0 41 42 1 0 0 0 0 41107 1 0 0 0 0 41108 1 0 0 0 0 42 43 1 0 0 0 0 42109 1 0 0 0 0 42110 1 0 0 0 0 43 44 1 0 0 0 0 43 51 1 0 0 0 0 43 52 1 0 0 0 0 44111 1 0 0 0 0 44112 1 0 0 0 0 45 56 1 0 0 0 0 45113 1 0 0 0 0 45114 1 0 0 0 0 46115 1 0 0 0 0 46116 1 0 0 0 0 46117 1 0 0 0 0 47118 1 0 0 0 0 47119 1 0 0 0 0 47120 1 0 0 0 0 48121 1 0 0 0 0 48122 1 0 0 0 0 48123 1 0 0 0 0 49124 1 0 0 0 0 49125 1 0 0 0 0 49126 1 0 0 0 0 50127 1 0 0 0 0 51128 1 0 0 0 0 51129 1 0 0 0 0 51130 1 0 0 0 0 52131 1 0 0 0 0 52132 1 0 0 0 0 52133 1 0 0 0 0 54 55 1 0 0 0 0 55134 1 0 0 0 0 55135 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 57 59 2 0 0 0 0 58136 1 0 0 0 0 58137 1 0 0 0 0 58138 1 0 0 0 0 60 61 1 0 0 0 0 60 67 1 0 0 0 0 60139 1 0 0 0 0 60140 1 0 0 0 0 61141 1 0 0 0 0 62 63 1 0 0 0 0 62 67 1 0 0 0 0 62 68 1 0 0 0 0 62142 1 0 0 0 0 63 64 1 0 0 0 0 63 69 1 0 0 0 0 63143 1 0 0 0 0 64 65 1 0 0 0 0 64 70 1 0 0 0 0 64144 1 0 0 0 0 65 66 1 0 0 0 0 65145 1 0 0 0 0 66 67 1 0 0 0 0 67146 1 0 0 0 0 68147 1 0 0 0 0 69148 1 0 0 0 0 70149 1 0 0 0 0 M END > 214 $$$$ 215 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.3740 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1540 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.5470 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 1.9770 0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1370 1.6250 1.2760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3170 0.1090 1.3640 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9530 -0.2630 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 2.3400 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -1.4320 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -0.2320 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 2.1020 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 3.4200 -0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 2.1010 2.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1850 0.5970 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 0.2710 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 1.4650 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 2.5250 2.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 1.4940 3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 -1.1100 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 3.9250 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 5.4150 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 3.1860 -2.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 2.7380 3.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.6770 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.7300 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5820 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.5190 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.5760 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -0.0540 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -1.3170 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 1.9380 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.4090 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -1.8910 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7010 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 1.7330 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 1.7220 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 3.1920 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -1.6500 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -1.0300 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -1.6460 4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 5.9140 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 5.7640 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 5.6440 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 2.6210 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 9 2 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 14 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 13 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 23 44 1 0 0 0 0 M END > 215 $$$$ 216 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.2560 1.5190 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.0150 0.0940 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7360 -0.7590 1.2450 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7410 1.8750 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.1690 1.5390 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1780 -0.3320 1.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8390 -1.0530 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -0.8020 2.5430 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6290 0.6990 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 1.4280 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 1.7700 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.1550 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -1.4890 3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -2.4250 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -1.1260 5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -0.1790 5.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -1.6800 6.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.3880 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.3680 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.7730 -3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -0.0250 -2.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 0.1290 6.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.6360 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 2.0370 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 1.8480 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.2260 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.5620 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 2.9540 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -0.6670 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -0.7020 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -2.1280 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.2060 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 1.0930 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 0.8590 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 1.0690 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 2.5000 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 1.7490 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.1910 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 2.8020 2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.5200 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 -2.9180 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 -2.6920 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -1.8440 -3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.2300 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -0.5370 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -0.7680 7.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 0.4790 7.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 0.9060 6.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.1470 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -1.0900 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 0.4170 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 12 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 M END > 216 $$$$ 217 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4950 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.7310 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 2.0610 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2280 1.2980 1.0360 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3950 -0.1490 0.5420 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4160 1.1200 2.2750 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5760 1.9560 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -0.2670 1.6860 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1390 -0.8960 1.6190 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4490 -2.2910 1.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -2.5840 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -1.3150 2.5590 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9980 -0.1510 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -1.4970 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 1.7270 2.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 1.2780 2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -3.6710 2.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 2.6040 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 2.8560 4.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 3.2740 3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 3.4500 0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -2.2310 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -0.2180 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8510 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8420 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5160 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 1.9310 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 1.0610 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 2.0450 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 2.9500 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -0.7650 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -1.0400 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 -1.7430 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -0.5730 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -2.3050 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 0.7840 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 0.7350 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 2.3000 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4750 3.8420 2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 3.9460 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 2.5160 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 3.9900 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -2.4930 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -2.6470 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.6380 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 19 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 M END > 217 $$$$ 218 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 77 80 0 0 1 0 0 0 0 0999 V2000 0.1420 0.9400 -0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.3830 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -1.0870 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -1.0110 -0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.7290 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 8.4780 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 5.2560 0.1820 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3550 5.3750 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 4.8210 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 3.5410 2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 2.5610 1.7830 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8500 3.8650 -0.3620 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5360 2.7730 0.4470 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4580 1.5500 -0.4850 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7100 2.1540 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 3.6530 -1.7980 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4840 4.4650 -2.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 3.1470 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.2000 2.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 3.9820 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 3.6590 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 6.2270 -0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 3.6940 -4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 3.1190 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 7.4400 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 7.6790 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 5.7750 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.6520 3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.2930 3.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -1.3000 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.5900 4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -3.3180 4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.7580 3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -1.4710 3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 9.7360 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 10.7010 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 10.4250 -3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 9.1800 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 8.2040 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 11.4840 -4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -1.0870 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.1140 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -0.5680 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 5.4430 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 6.4230 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 4.8100 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 3.1770 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 2.7580 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 0.8260 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 2.0470 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 1.6570 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 4.3440 -2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 2.3480 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 3.2860 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 4.0720 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 5.0350 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 2.6410 -4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 3.9290 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 4.3090 -4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 2.0700 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 3.4130 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 3.2600 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 5.9380 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 5.3520 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 6.7250 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -0.7330 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -3.0330 5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.3270 4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -3.3300 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -1.0350 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 9.9530 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 11.6750 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 8.9720 -4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 7.2330 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 11.4080 -5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 11.3420 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 12.4700 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 5 28 1 0 0 0 0 5 30 1 0 0 0 0 5 34 2 0 0 0 0 6 25 1 0 0 0 0 6 35 1 0 0 0 0 6 39 2 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 28 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 20 56 1 0 0 0 0 22 25 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 2 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 29 2 0 0 0 0 30 31 2 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 32 33 2 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 69 1 0 0 0 0 34 70 1 0 0 0 0 35 36 2 0 0 0 0 35 71 1 0 0 0 0 36 37 1 0 0 0 0 36 72 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 73 1 0 0 0 0 39 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 M END > 218 $$$$ 219 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -2.1870 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1460 3.5950 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -2.6810 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -4.1330 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -4.7290 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -6.2330 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -4.0600 -3.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -6.7980 -2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -6.6500 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -2.6930 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -2.6800 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 4.0860 -1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 5.4180 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 6.0010 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 6.1480 -0.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 3.9410 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 3.9700 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -2.3200 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -2.3040 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -6.6200 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -6.5010 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -6.4110 -3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -7.8860 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -6.2480 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -7.7380 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -6.2630 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.3410 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -3.7830 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -2.3160 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -2.3980 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -0.8190 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 6.1250 -3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 6.9700 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 5.3300 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 19 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M END > 219 $$$$ 220 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.1350 1.2270 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.2680 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -0.5450 -1.6500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4620 1.9480 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.7900 -1.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5780 0.2960 -1.5460 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5490 0.0710 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 0.6080 -2.2680 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6980 2.4360 -1.0290 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8140 2.0980 -2.0080 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6640 2.8710 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 4.3070 -2.8540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8870 4.7930 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 3.9310 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.3890 -2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -2.0350 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -0.0630 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 2.4740 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 0.3600 -3.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 2.6510 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 4.0140 -2.0320 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7940 2.1000 -0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 5.0870 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 1.9850 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -2.8680 -1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -4.1960 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -4.6460 -1.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -5.1240 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 1.6380 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.3710 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.6860 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -0.7650 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 3.0060 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 1.5130 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -0.9890 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 0.6000 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 0.1030 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 2.5250 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 2.8340 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 4.9730 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 5.8260 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 4.8270 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 4.1790 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 4.1780 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.5850 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.4680 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -1.1740 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -2.2950 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -2.1980 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 3.5520 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 2.2450 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 2.1150 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -0.5760 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 3.9480 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 5.1540 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 4.8280 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 6.0470 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -4.5400 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -5.8000 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -5.7030 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 25 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 M END > 220 $$$$ 221 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0680 1.1540 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -0.3460 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -0.6470 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 1.8770 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 1.6830 -1.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4960 0.1840 -1.5500 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4470 -0.0610 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 0.4600 -2.3030 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6450 2.3140 -1.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7520 1.9490 -2.0290 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6490 2.7440 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 4.1560 -2.8220 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8480 4.6670 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 3.8080 -0.7840 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6250 -2.1390 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -0.1700 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.4930 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 2.3630 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.8620 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 0.2020 -3.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 2.4640 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 3.8540 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1930 4.6930 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 1.8390 -0.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 4.1420 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 -0.9690 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -1.7520 -2.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -1.3070 -4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.5430 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.3230 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.7330 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -0.8520 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 2.9400 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 1.4680 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -1.1240 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 0.4640 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -0.0560 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 2.3940 -4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 2.7330 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 4.8330 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 5.6950 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 4.6900 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 4.0590 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -2.7550 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -2.4140 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -2.2980 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.4870 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.5860 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -1.2700 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 3.4430 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 2.1150 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 2.0170 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 5.6940 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 4.3710 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 5.0830 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 -0.9540 -4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -2.3870 -4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -0.8250 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 25 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 2 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END > 221 $$$$ 222 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0580 1.1460 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -0.3530 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -0.6570 -1.6210 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3880 1.8700 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.6740 -1.3410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4850 0.1740 -1.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4350 -0.0720 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 0.4480 -2.3050 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6360 2.2980 -1.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7440 1.9360 -2.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6440 2.7350 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 4.1480 -2.8140 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8270 4.6500 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 3.7910 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1870 3.8480 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 2.4560 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 1.8340 -0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 4.6920 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.1500 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.5050 -2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.3510 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 0.1960 -3.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -2.9710 -1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -4.2980 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -5.2140 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -4.7600 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.5340 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.3170 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.7390 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -0.8610 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.9340 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 1.4640 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.1790 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -1.1340 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 0.4540 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -0.0710 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.8370 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 2.3910 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 2.7200 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 4.8300 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 5.6810 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 4.6540 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 4.0550 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 4.0270 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 5.6950 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 4.3720 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -2.4260 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -2.3080 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.4760 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -0.6010 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -1.2800 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 3.4310 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 2.1040 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 2.0040 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -0.7400 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -5.5030 -2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -6.1050 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -4.6960 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 17 2 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 23 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 M END > 222 $$$$ 223 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0590 1.1430 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -0.3550 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.6550 -1.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3870 1.8700 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 1.6790 -1.3410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4880 0.1800 -1.5470 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4380 -0.0620 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 0.4620 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 2.3140 -1.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7390 1.9500 -2.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6390 2.7440 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 4.1560 -2.8240 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8350 4.6660 -2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 3.8090 -0.7870 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4760 -0.5050 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -0.1720 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.1460 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 2.3560 -2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 1.8660 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 2.4660 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 3.8540 -1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 4.6930 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 1.8400 -0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 4.1460 0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -2.9710 -1.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -4.2980 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -4.7550 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -5.2180 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.5320 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.3110 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.7430 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.8630 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 2.9320 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 1.4600 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -1.1260 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 0.4590 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -0.0570 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 0.2830 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 2.3860 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 2.7320 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 4.8330 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 5.6950 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 4.6860 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 4.0600 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.4740 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -0.5990 -3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -1.2830 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -2.4190 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -2.3020 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 3.4360 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 2.1100 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 2.0060 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1970 5.6940 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9590 4.3720 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 5.0870 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -5.0930 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -6.2510 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -4.9750 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 24 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 17 25 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 22 2 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END > 223 $$$$ 224 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0550 1.1400 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.3590 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6630 -1.6140 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3840 1.8660 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 1.6720 -1.3420 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4840 0.1720 -1.5420 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4330 -0.0730 -2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 0.4500 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 2.3060 -1.0590 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7360 1.9380 -2.0310 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6410 2.7290 -3.3500 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0240 4.1460 -2.8310 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8100 4.6490 -2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 3.8020 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.5250 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -2.1530 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.1760 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 2.3400 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -0.0640 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 2.2680 -4.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 2.4620 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 3.8560 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 1.8390 -0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 4.7110 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 1.8600 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -2.9800 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -4.3060 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -4.7620 -1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -5.2280 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.5280 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.3100 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -0.7480 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -0.8640 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.9290 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 1.4570 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -1.1360 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 0.4500 -3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 0.2530 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 2.7180 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 4.8210 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 5.6850 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 4.6430 -2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 4.0660 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 4.0520 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.4520 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.6220 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -1.3060 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -2.4310 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -2.3030 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 3.4210 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 2.0940 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 1.9850 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 2.7360 -5.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 5.7150 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8990 4.3980 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -4.6400 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -5.9190 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -5.7910 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 26 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END > 224 $$$$ 225 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 0.3780 3.0520 1.9940 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0820 1.6130 1.7690 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5930 0.6710 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 3.1320 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 2.2510 2.7980 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1030 0.8180 2.7310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7800 -0.0530 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.1430 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 2.2290 2.4230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8210 1.2660 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 3.6540 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 3.6250 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 4.5350 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 1.6380 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 5.5370 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 4.6570 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 3.9200 1.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 1.5330 1.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.8840 4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.7660 2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3400 5.4090 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 4.4510 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 5.3590 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 4.2020 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 2.8630 4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 3.3850 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 1.3020 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 2.7940 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 4.1700 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.4160 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 0.3540 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -1.0650 3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -0.6710 4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -0.6710 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 1.9010 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 2.9590 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 4.3550 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 3.8710 3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 0.9240 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 2.6600 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1340 5.6270 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 6.1640 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5720 4.0300 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 2.0900 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 0.5640 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 0.2980 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 1.9400 4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.9400 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -1.4820 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.8890 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 6.2870 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 5.7240 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 4.8480 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 5.4660 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 4.9310 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 6.3380 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 3.0040 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 2.1950 4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.8260 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 17 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 21 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 22 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 M END > 225 $$$$ 226 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 0.3890 3.0520 2.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0690 1.6140 1.7920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6130 0.6680 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 3.1370 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 2.2530 2.8120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1230 0.8190 2.7370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8080 -0.0570 3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 -0.1400 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 2.2390 2.4320 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8420 1.2710 3.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 3.6750 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 3.6360 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 4.5630 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 1.6420 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 5.5830 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 4.6940 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 3.9080 1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 1.5290 1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.8700 4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -0.7680 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 5.4370 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 2.8560 4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 1.7260 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 1.9620 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 1.6530 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 3.3810 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.3080 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 2.8030 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 4.1760 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 0.4250 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 0.3420 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -1.0700 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -0.6740 4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.6590 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 1.9200 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 2.9800 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 4.3680 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 3.8730 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.9240 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 2.6660 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1260 5.6790 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 6.2090 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 4.0680 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 4.8420 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 0.5460 4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 0.2830 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 1.9260 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -0.9350 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.4860 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -0.8940 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 6.3100 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 5.7600 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 4.8730 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 2.9940 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 2.1850 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 3.8200 4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 2.6420 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 1.3080 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 0.9570 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 17 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 21 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 23 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 M END > 226 $$$$ 227 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 0.4260 2.9970 -0.6130 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5460 -0.3070 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.5210 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.2050 -2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 1.1520 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 1.4900 -0.8350 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3510 1.1860 -2.3170 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7100 1.5980 -2.8630 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8910 3.1080 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 3.4230 -1.1570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8940 -1.3030 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.2370 -4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 3.7330 -1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.8930 -2.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 4.9360 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 3.2990 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 3.0840 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 4.1270 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.8770 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 0.7310 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.6900 -2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -0.0380 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 1.0910 -4.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 5.2760 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 5.9990 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 5.1320 4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 4.0290 3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 3.0940 4.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.5250 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.9760 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -1.5590 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.1330 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 1.8000 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 1.3000 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 1.4200 -3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 3.4060 -3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 3.6440 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 2.9140 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -2.2310 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.0130 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -1.4510 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 0.5090 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -0.0180 -4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -1.2260 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 4.6920 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 5.4570 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 5.1570 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 5.2660 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 2.6330 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 4.3340 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.1680 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 2.0920 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.3360 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.0810 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 0.9050 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -1.1070 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 0.3260 -2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 0.1410 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 5.6250 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 6.9540 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 6.1580 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 15 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 24 2 0 0 0 0 18 27 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END > 227 $$$$ 228 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 90 0 0 1 0 0 0 0 0999 V2000 1.2230 2.2800 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.8000 -0.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3280 0.0140 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 2.4470 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 1.7310 0.8770 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7980 0.2750 0.8580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3320 -0.3820 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.4230 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 1.8530 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 0.8820 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 3.2470 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 3.1600 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 0.6600 -0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 2.4730 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 0.6700 -2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.3180 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -1.4860 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 0.5290 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.7910 -2.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3370 2.4600 1.8210 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9520 1.0100 1.5740 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6610 0.3030 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 1.0160 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 2.3460 2.0460 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3290 3.5020 2.9270 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8180 3.3230 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2660 4.3910 4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8510 4.0560 5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2990 5.1240 6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5870 4.9310 7.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8120 5.0230 6.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9760 6.4110 5.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 3.0090 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 4.8270 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 0.4920 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 2.3450 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 2.7920 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 2.7310 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 0.3820 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 2.0180 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 3.5090 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -0.1990 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 0.1620 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -1.4090 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -0.6820 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -1.2050 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 2.9040 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 4.3070 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 3.3490 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 3.9680 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 2.5730 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 1.9120 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 3.4630 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.0850 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.1420 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.3970 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -1.7340 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.0900 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -1.6890 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.3480 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 0.5590 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -0.4210 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 0.4210 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -0.7600 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 1.2000 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 0.4110 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 3.5080 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 2.3410 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3900 3.4060 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1040 5.4330 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0140 3.0140 5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8330 3.9500 8.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9100 5.7040 8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5090 5.0040 7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3190 5.1600 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1350 5.7950 7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0580 4.0410 6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3940 6.6020 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 2.9120 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 2.4450 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 4.0600 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5520 4.7650 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 5.0260 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 5.6330 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 1.0910 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 0.5660 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -0.5490 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 27 28 2 0 0 0 0 27 70 1 0 0 0 0 28 29 1 0 0 0 0 28 71 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 M END > 228 $$$$ 229 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 1.5950 3.3570 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.3380 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 1.0170 0.3530 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9420 2.6770 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 1.4780 1.4120 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8230 0.4720 0.7500 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7150 -0.7930 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -1.4670 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 0.8210 1.5780 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1170 -0.5360 2.2800 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5610 1.1650 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 1.7760 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -0.1560 2.8570 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5130 -1.1160 2.1530 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8510 -2.3520 3.0160 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3850 -2.2740 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7550 -1.0040 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 2.5650 -1.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.1770 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 0.1620 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.0430 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 2.0100 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 0.6530 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -0.4170 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -1.3920 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 0.0130 3.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -3.5490 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 0.5750 -1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -0.1560 -1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -1.2050 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 0.3320 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 4.1670 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 3.7810 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 2.3190 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 3.3900 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -0.5700 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -1.4920 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -2.3910 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -1.6990 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 1.0500 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 1.8360 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 2.7100 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 1.9840 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -2.2700 4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0480 -3.1210 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 -0.6340 2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 1.4050 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 0.2510 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 1.9910 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.0730 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -0.9260 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 2.6520 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 1.1750 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 2.5840 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -1.3690 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.3580 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -0.1540 3.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.4620 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -1.8060 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -2.1060 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -4.3540 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 1.2870 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 0.4570 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -0.3970 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 18 2 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 10 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 21 28 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 M END > 229 $$$$ 230 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 0.7290 2.2790 -1.7580 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0640 2.7840 -1.2070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3150 2.1650 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 0.7550 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.3570 -0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.9720 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -3.3270 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -4.0900 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -3.4380 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.3110 -0.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 0.1350 -0.5090 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3600 0.6410 0.0420 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6110 0.0210 1.4180 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0100 0.4070 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 2.4120 -2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 2.8980 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -4.2010 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.5380 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -0.1900 3.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9980 0.1720 4.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 0.2080 4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -0.7090 5.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.1690 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -0.3050 5.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -0.7450 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 -0.4410 5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -1.8150 5.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 2.5630 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 3.8700 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 2.5250 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 2.4490 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 0.3940 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 0.4710 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.7710 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -2.6330 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -4.0250 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -5.1670 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 0.4190 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 0.3570 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -1.0640 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -0.1850 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 0.2160 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 1.4660 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 2.7010 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 2.5380 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 3.9840 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 2.6150 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -4.4640 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -5.1090 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -3.5810 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 1.6090 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.3540 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -1.2660 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 1.2480 4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -2.2640 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.6600 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -2.6370 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2220 5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -1.0580 6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 0.6570 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 0.5620 5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 -0.5010 6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -1.1660 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 29 1 0 0 0 0 3 12 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 11 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 M END > 230 $$$$ 231 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 1.6760 3.4190 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 2.1740 -0.8530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9050 1.1080 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 3.0520 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 1.9850 1.2260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3240 0.7410 0.6840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2550 -0.3200 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.6930 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 1.6250 1.6720 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3930 0.5470 2.7540 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4500 2.5140 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 2.8770 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 1.3180 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 0.1610 3.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7350 -0.4980 4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1520 -0.8620 5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 1.0740 3.7990 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9900 0.4100 5.1700 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3660 0.0720 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 -0.8700 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2650 -0.1870 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8840 0.1330 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0590 1.1090 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0110 -1.1210 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 1.3620 6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 0.9940 7.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 2.4570 5.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 -0.8770 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 1.0850 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 2.5320 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 3.6770 2.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 1.6550 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.1370 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 1.6360 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 2.4020 -3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 1.8180 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 0.5140 -1.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6720 2.0190 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 1.2620 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 0.3500 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 4.1790 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 3.8090 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 2.4360 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 2.6630 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 3.9390 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 0.0770 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -1.2060 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -1.4540 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -1.0840 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2080 3.2820 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 3.6300 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 3.2750 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 0.1960 5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -1.4010 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -1.3700 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 -1.5210 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9430 0.9880 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -0.4140 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0860 -1.1050 5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5290 -1.7890 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 -0.7910 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 0.6120 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0430 0.8810 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1740 1.5950 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5270 1.7750 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4440 -2.0440 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1260 -0.6350 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9940 -1.3510 2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 1.6390 7.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -0.3680 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 -1.4960 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -1.5060 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 0.7360 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 2.1750 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.7290 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 2.8150 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 1.7640 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 4.0310 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 1.2850 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.3240 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.7440 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.5270 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.8970 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 0.1240 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 2.5410 -5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 1.5500 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 0.9250 -4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 30 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 34 35 1 0 0 0 0 34 37 2 0 0 0 0 35 36 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 M END > 231 $$$$ 232 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 68 69 0 0 1 0 0 0 0 0999 V2000 0.3390 0.8520 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 1.4430 0.4780 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5920 -0.3590 -1.1360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5680 1.1310 -0.7640 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2600 -0.6630 -5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 0.2560 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.3450 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -0.4540 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.6340 0.1720 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1960 -0.9000 -1.1250 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9880 -2.4110 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -2.5560 -0.9990 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9360 -1.3020 -0.1810 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6520 -0.6480 -7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -1.6480 -7.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -1.5680 -9.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 1.2080 -5.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -2.6100 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -1.7060 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.4050 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -1.3720 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.0420 1.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 1.8350 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 2.8320 2.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 1.4800 4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.1250 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 1.6080 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 0.2640 -7.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -1.5880 -2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -3.9380 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -0.4190 -0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 1.0400 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 1.3390 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 2.5450 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 1.6900 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -1.4190 -5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.3880 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.0660 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -0.0450 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -1.4970 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -2.7060 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -2.9980 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -3.4580 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -0.6550 -9.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -1.5580 -9.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -2.4320 -9.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 2.0450 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 1.5800 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 0.6880 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -2.3510 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.8130 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -2.2430 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -1.2200 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.4370 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -0.9870 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 1.4430 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 2.2350 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 0.5070 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -2.1890 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -0.7680 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.9650 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 1.1530 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 1.3170 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 2.6930 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -4.7400 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -4.0720 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -3.9640 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.8040 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 43 1 0 0 0 0 13 19 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 28 2 0 0 0 0 15 16 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 29 2 0 0 0 0 18 30 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 M END > 232 $$$$ 233 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 66 0 0 1 0 0 0 0 0999 V2000 -1.3380 1.4680 1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 0.0170 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -0.5420 1.3110 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6280 -2.0680 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -2.6100 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -4.0960 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -4.3770 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -5.8850 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -6.1660 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5250 -7.6740 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9860 -7.9560 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1910 -9.4630 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6310 -9.7400 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9320 -10.2810 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 2.1180 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 3.6250 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 1.4960 1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -0.1370 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -0.1720 2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -1.8550 0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8680 -10.4470 -3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6560 -11.9140 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -12.3710 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8680 -11.4120 -6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7900 -11.7160 -7.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 -10.7420 -8.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 -11.0460 -9.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9800 -10.0720 -10.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -0.3390 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.3170 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -2.3510 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -2.4790 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -4.4690 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -4.5960 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 -4.0040 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 -3.8760 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -6.2580 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -6.3860 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9650 -5.7930 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -5.6660 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8790 -8.0470 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 -8.1750 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6310 -7.5820 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2360 -7.4550 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5460 -9.8370 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9420 -9.9640 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4140 -9.4930 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9420 -10.6080 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 4.0080 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 3.9700 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 3.9860 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -0.4990 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1850 -9.9500 -4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9360 -10.0040 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4370 -12.5880 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7070 -13.4350 -5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8530 -11.5240 -6.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7480 -10.3900 -5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 -11.6050 -6.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9100 -12.7380 -7.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9090 -10.8540 -8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 -9.7210 -7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8600 -10.9350 -8.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9660 -12.0680 -9.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -10.2890 -11.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 -10.1840 -10.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 -9.0510 -10.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 20 2 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 21 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 19 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 M END > 233 $$$$ 234 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 64 0 0 1 0 0 0 0 0999 V2000 -0.0980 1.0970 2.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.3550 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.8760 1.8520 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4670 -2.3990 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.9010 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -4.3330 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -4.7770 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -6.2530 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 -6.7120 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -8.2100 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 -8.6700 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 -10.1680 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4070 -10.6200 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5150 -11.0810 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 1.7160 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.2210 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.0660 2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.4360 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -0.5160 2.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -2.1170 1.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -10.9800 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8320 -12.3630 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8690 -12.7020 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8890 -11.6620 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0980 -11.6950 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1330 -10.6400 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3430 -10.6730 -4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3780 -9.6170 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.7050 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.7230 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.6780 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.8430 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -5.0310 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -4.0790 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -6.4440 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -6.8020 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -6.5220 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5690 -6.1630 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -8.4010 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -8.7600 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 -8.4790 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9500 -8.1200 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5450 -10.3580 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 -10.7170 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2990 -10.5650 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2640 -11.5340 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 3.5730 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 3.5500 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 3.6290 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.8730 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6770 -10.4450 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9180 -10.4400 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -13.0760 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9940 -13.7260 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8330 -11.8730 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5320 -10.6750 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1540 -11.4840 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4550 -12.6820 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0770 -10.8510 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7770 -9.6530 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3990 -10.4620 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6990 -11.6600 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5270 -9.6410 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3220 -9.8280 -4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0210 -8.6310 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 20 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 19 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 M END > 234 $$$$ 235 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.1500 0.9850 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.5200 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -0.8830 -1.4940 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1920 1.7070 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 1.4250 -1.3300 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 -0.0760 -1.5430 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0070 -0.3390 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 0.2350 -2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 2.0070 -1.0760 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3200 1.6910 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 2.5840 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 4.0450 -2.5790 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6890 4.1980 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 3.4730 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.7470 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 2.1110 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 4.7560 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 5.3280 -2.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.3760 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -0.4380 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 1.4670 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 4.6520 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 4.7520 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 5.4880 -5.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -3.1740 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -4.5010 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -4.9810 -1.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -5.3930 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 1.3210 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 1.2130 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.8390 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -1.0440 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.7810 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.3590 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -1.4160 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 0.1020 -3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -0.3300 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 0.1650 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 2.2630 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 3.7730 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 5.2580 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 3.9710 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 3.5560 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 0.2490 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.9010 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -1.4940 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 3.1920 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 1.8250 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 1.8050 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -2.6890 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -2.5180 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 4.5300 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 5.7130 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 4.1450 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 5.2160 -5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 3.7260 -5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 5.5280 -6.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -4.7860 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -6.1060 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -5.9340 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 19 25 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 M END > 235 $$$$ 236 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.3060 1.2910 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.2290 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.6390 -0.4720 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3970 -1.8260 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -2.7150 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -2.1430 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -2.8980 0.6150 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8570 -4.1870 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -0.0700 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -4.9750 -0.2840 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2330 -4.3720 0.3780 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0910 -4.8900 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -6.0180 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -6.2560 -0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -6.6380 -2.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -4.4350 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.7020 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 3.1440 -0.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -2.6560 1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 3.6700 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 5.1600 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 2.9490 -0.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.6040 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 1.7690 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.7070 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.5410 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -0.2500 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -1.5590 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -2.3560 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 -0.9210 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.5230 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -4.3980 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -4.5250 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.2900 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 1.0100 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -0.5240 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -5.0900 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -4.8490 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -3.5970 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -4.9060 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 1.3900 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 1.2240 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -1.7600 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 5.6410 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 5.5410 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 5.3750 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 11 1 0 0 0 0 7 19 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 M END > 236 $$$$ 237 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 92 98 0 0 1 0 0 0 0 0999 V2000 -0.0970 0.1670 0.3340 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1860 -1.3140 0.0630 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1210 -1.8510 1.1510 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4000 -1.0100 1.1750 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0630 0.3600 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 0.9300 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -1.4700 2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 0.6970 -0.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -2.0470 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -3.2130 0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 0.3980 3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -0.8240 2.2630 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5700 -1.8450 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 1.0690 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 0.1180 3.9220 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8560 -1.2700 3.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1870 -1.8660 2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -1.3830 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 0.8120 4.2020 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4890 0.1260 3.8030 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7420 2.8730 2.8570 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1750 2.3460 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 2.2480 2.7310 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9440 0.7440 2.4790 C 0 0 1 0 0 0 0 0 0 0 0 0 11.3330 0.3320 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1870 2.6880 1.7080 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5130 1.4190 0.9040 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8470 1.6450 0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9600 2.7410 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4390 4.0550 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0440 3.8470 0.7240 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9350 -2.7600 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -2.6990 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 0.1950 5.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7850 2.3530 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8820 0.5200 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4620 2.6730 -1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 3.4860 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8420 4.3210 2.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 5.0160 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8410 6.5230 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 4.4340 1.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 0.2700 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.4220 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.7890 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -1.1050 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.8600 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.9770 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 1.6330 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -1.7540 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -3.6180 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 1.1370 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 0.1060 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -0.4920 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 1.6990 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 1.7100 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -1.8220 4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1240 -2.9500 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3530 -1.6220 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 -1.8240 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2900 -1.7440 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 0.3500 4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 2.5600 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 2.6980 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7810 2.7210 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0860 0.4100 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3180 -0.6640 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 2.8900 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7920 1.2830 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1150 4.4250 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3790 4.7820 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7210 4.7480 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -3.2660 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -3.5010 4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -2.1650 4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -2.0600 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 -3.4390 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -3.2070 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 0.8770 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -0.7230 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 1.9010 4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7420 1.8310 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 3.4020 4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 0.6290 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0100 1.2560 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9890 -0.4830 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0710 3.2760 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9490 4.3210 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3930 2.6040 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 6.8800 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8250 6.9080 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 6.8710 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 12 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 20 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 24 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 27 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 69 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 37 2 0 0 0 0 30 31 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 31 38 1 0 0 0 0 31 72 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 38 87 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 90 1 0 0 0 0 41 91 1 0 0 0 0 41 92 1 0 0 0 0 M END > 237 $$$$ 238 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 96 0 0 1 0 0 0 0 0999 V2000 2.2060 0.1950 -0.9360 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1400 -1.3200 -0.7160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6620 -1.6440 0.6870 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0840 -1.0980 0.8330 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0800 0.3100 0.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 0.6700 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -1.3470 2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 0.5030 -2.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.7610 -0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -3.0600 0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 0.4700 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 -0.9760 2.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5390 -1.9040 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 0.7100 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -0.4370 5.0030 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1620 -1.4630 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 -1.9330 5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 -1.5330 7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 -0.2340 6.4320 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1910 -1.1280 7.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3260 1.2600 8.0530 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2650 1.2040 6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 0.0360 8.8960 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0140 -0.4150 8.8440 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1510 -1.3040 10.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 0.0050 10.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3850 -0.4410 11.1240 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9010 -1.1280 12.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -0.4960 12.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 0.9860 12.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 1.1960 11.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0340 -3.3300 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 -1.8810 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.9510 5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -1.0860 8.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 0.7970 8.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -1.0950 13.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 2.4740 10.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 1.3100 7.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.5260 7.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 2.6570 6.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 3.5160 7.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 0.6960 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -1.8230 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -1.1810 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.5910 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 0.2000 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 1.7540 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 1.4470 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -1.5810 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -3.3380 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 0.7010 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 1.1270 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -1.0700 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 1.6390 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 0.7990 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 -2.6650 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 -2.3710 7.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -0.6950 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -2.0370 7.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 2.1490 8.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 1.7180 7.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 1.7140 6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -2.2710 9.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -1.4260 10.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -0.8070 10.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 0.4270 11.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 1.3660 13.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 1.5190 12.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 1.2640 10.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -3.6570 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 -3.9970 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -3.3500 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 -0.8650 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 -2.5460 3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -2.2140 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.4120 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -2.0270 5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -1.1420 7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -2.0340 8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -0.8800 8.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 1.6840 8.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 0.9470 9.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 0.6230 8.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 2.8790 9.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 3.2080 11.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 2.2450 10.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.6650 6.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 3.2220 7.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 3.1780 5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 12 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 20 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 24 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 21 61 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 27 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 67 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 37 2 0 0 0 0 30 31 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 38 1 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 32 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 38 85 1 0 0 0 0 38 86 1 0 0 0 0 38 87 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 88 1 0 0 0 0 41 89 1 0 0 0 0 41 90 1 0 0 0 0 M END > 238 $$$$ 239 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4960 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.6310 -1.1920 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2800 1.8720 -1.1980 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4090 2.0180 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4510 3.4980 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 4.0080 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 2.9360 -0.8350 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1180 -0.7000 -1.2370 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9590 0.5560 -1.4710 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2350 0.4890 -2.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.7970 -3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -1.6880 -2.2730 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9620 3.4470 -2.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -1.1820 -4.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -2.6430 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.1100 -2.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 1.3530 1.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 2.1010 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.8740 1.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 2.3860 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -0.7580 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -1.7290 -2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.2730 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -1.0890 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.3650 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.3630 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -1.6960 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 4.0360 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 5.0390 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 2.5000 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 0.4930 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -2.2450 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 4.1780 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -2.0670 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -3.2570 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -3.2850 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 1.5140 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 1.7630 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 3.1880 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.7880 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 1.5410 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 1.6700 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.3460 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 2.5110 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.2970 -5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.9200 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 0.7480 -4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 9 1 0 0 0 0 3 17 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 14 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 22 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 M END > 239 $$$$ 240 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.4640 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0660 0.0410 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9150 -0.5180 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 2.0330 -0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1330 1.6230 1.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2920 0.0920 1.2860 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2430 1.8510 2.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4800 2.3230 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 2.1900 3.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 0.3480 2.5330 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9620 -0.2630 2.5920 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2700 -1.6510 2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -1.6290 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -0.3630 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 0.0460 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -2.5080 4.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 3.3680 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 3.7880 5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 5.1600 6.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 3.8670 5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 4.0920 3.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 2.0210 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 3.4590 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -0.5970 0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -0.2380 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.8350 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -1.3860 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -0.6090 -1.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -1.4070 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.8000 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8170 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.4260 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.6440 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 2.3210 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 2.1030 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 3.3990 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 0.0790 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.1700 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 -0.5720 5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 0.9970 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 3.0570 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 5.8900 5.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 5.4630 7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 5.1030 6.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.8900 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 4.1710 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 4.5980 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 1.6050 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 1.6340 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 3.1080 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 3.7920 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -1.5250 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -0.6880 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -2.3440 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -1.8310 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.7160 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 29 2 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 2 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END > 240 $$$$ 241 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6140 -0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 2.1480 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 1.4550 -0.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3180 0.0150 0.4780 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6040 -0.7580 0.1760 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6200 -2.2580 0.4780 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9670 1.4440 -1.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -2.8680 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -3.1110 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 -3.6700 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 -3.9860 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 -3.7430 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -3.1880 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.6490 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.0180 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -0.2030 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -1.7460 -0.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.7030 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 2.4850 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 3.3750 -0.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 2.5420 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9970 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 3.2280 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 1.9930 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -2.8640 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -3.8600 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 -4.4220 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 -3.9900 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 -2.9990 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 1.6590 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 3.4380 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 2.5720 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 16 2 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 M END > 241 $$$$ 242 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.2860 1.2160 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -0.2780 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -1.1220 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 1.4840 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 0.7060 1.1760 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7260 -0.7840 1.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4590 -1.5700 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -1.4330 1.9040 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5330 0.8790 0.8400 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3300 0.0400 1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 0.5040 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 1.9400 2.4850 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4260 2.5170 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 2.3320 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 1.2240 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -1.1080 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -1.0010 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.5940 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 2.7400 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 1.9990 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7240 2.7530 3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 2.2790 -0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 0.4560 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -2.0470 3.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -3.3490 2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -4.0540 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -3.9560 1.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.7930 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 1.5010 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -0.5140 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.5230 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -1.2260 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -2.6320 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -1.9390 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 -0.1620 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 3.5810 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 2.0030 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 2.7100 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 2.9380 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 1.2040 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 0.5900 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 2.2470 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.4670 2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -1.5010 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 0.0520 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.7110 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -3.2450 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -2.8620 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 2.3190 4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 3.7780 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 2.6930 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 1.4190 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 3.2640 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7930 2.8630 3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -3.3500 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -4.8760 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -4.4460 3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 22 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 M END > 242 $$$$ 243 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.1380 0.9580 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.5450 -0.3110 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9950 -0.8960 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.6970 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.4410 -1.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2580 -0.0610 -1.5220 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1380 -0.3290 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 0.2690 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 2.0740 -1.1220 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4090 1.7820 -2.2530 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6880 4.1020 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 3.5840 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 3.7930 -1.4920 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7910 2.3120 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 5.5080 -2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 4.6500 -2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 4.1510 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 2.3920 -3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 1.6400 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 2.0890 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -1.2420 -0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -2.3800 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.3880 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -0.7940 -2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -1.6070 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.3330 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -1.3530 1.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 1.2990 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 1.1690 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.8760 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 2.7660 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 1.3420 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -1.4020 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 0.1150 -3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -0.1940 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 0.0790 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 5.1810 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 3.6240 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 4.0770 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 3.8040 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 1.7360 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 2.1540 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 5.6010 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 6.1240 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 4.5580 -3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2890 3.5550 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 3.9400 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 5.2100 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 2.2500 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 3.1730 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 1.8100 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 1.7470 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.9990 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -2.6870 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -2.5000 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 0.1850 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.9210 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -1.5710 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -2.4720 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -3.3060 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -1.7470 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 19 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 25 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 M END > 243 $$$$ 244 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -0.3940 0.5350 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -0.8150 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -1.3570 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 1.4050 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 0.8880 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -0.5090 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -1.0390 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -0.1160 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 1.2120 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 1.7700 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -2.2220 0.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 2.9430 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 2.7450 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.7000 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -0.6690 -0.4130 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7850 -1.4060 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -1.8530 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 -3.1260 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -4.1540 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -3.5620 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4690 -1.5910 0.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 -1.6970 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 -1.0410 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 -2.6340 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 -2.4610 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4540 -2.7010 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2650 -1.0360 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 -3.4600 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7830 -2.5880 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4100 -2.8220 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4770 -2.2980 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 0.9360 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.4720 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 1.8780 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 3.1740 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -3.0500 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 0.1490 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -2.2770 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -0.7380 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9000 -1.1230 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -4.2700 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 -5.1090 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -3.8280 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2670 -2.6860 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 -4.2140 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 -4.1020 -4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 -2.4080 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 -3.6630 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 -0.8560 3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3480 -0.9130 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8280 -0.3250 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2210 -4.4700 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 -3.3920 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 -3.2280 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6320 -3.0710 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9290 -1.9200 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1200 -3.6460 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 12 2 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END > 244 $$$$ 245 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.1030 1.1550 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.3620 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.7980 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 1.8050 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 1.4500 -1.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1730 -0.0560 -1.5140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9130 -0.3790 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 0.0760 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 2.0210 -1.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4290 1.5700 -2.2720 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7990 2.5710 -3.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3470 3.5030 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 4.4120 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 4.0410 -3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 5.1650 -3.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 6.2430 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 5.7590 -1.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 7.4230 -3.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 2.1460 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -0.4340 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.3040 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.6530 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 1.6220 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 2.0700 -2.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 5.2800 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 3.9520 -5.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 3.8780 -6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 2.5340 -7.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 4.8900 -7.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 1.5020 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.4350 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.6930 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.8320 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 2.8880 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 1.4480 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -1.4590 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 0.1100 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -0.5140 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -0.0790 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 2.2680 -4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 3.8640 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 3.2260 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 1.8640 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 1.8460 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.8560 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -2.6680 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -2.4490 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 0.3600 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.8500 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -1.3660 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 5.7980 -5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 5.8410 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3710 1.9570 -7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 2.6740 -7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8560 2.0000 -6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 10 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 14 1 0 0 0 0 11 24 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END > 245 $$$$ 246 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.1240 1.2250 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.2960 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -0.7340 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 1.8980 0.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9680 1.4840 -1.2580 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2340 -0.0260 -1.2220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8770 -0.4490 -2.5420 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2080 0.2900 -2.7080 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9680 1.8000 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 2.2210 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -1.6970 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -0.2590 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -1.8590 -2.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -0.1220 -4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 0.3580 -5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 0.5090 -4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 3.3410 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 1.8150 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 3.9390 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 3.2790 2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 5.4330 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.4940 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.5620 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.5770 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.7750 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 1.5910 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -0.1960 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 0.0290 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 2.3180 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 2.0630 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 3.2970 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 1.9660 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.1920 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.9950 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -2.2120 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -1.2080 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.0920 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 1.4430 -5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 0.0640 -6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 0.2540 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 0.1310 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 1.5920 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.8860 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 1.5190 -3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.2740 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 5.8530 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 5.6610 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 5.8660 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 M END > 246 $$$$ 247 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0390 1.1260 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.3740 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.6830 -1.6120 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3710 1.8500 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 1.6470 -1.3460 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4630 0.1470 -1.5480 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4000 -0.1010 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.4200 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 2.2790 -1.0640 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7170 1.9060 -2.0400 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6290 2.7110 -3.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 4.1250 -2.8340 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8090 4.6310 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 3.7760 -0.8040 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4400 -0.5400 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -0.2040 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -2.1530 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 2.3210 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 1.8350 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0570 2.4070 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 3.8550 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 4.7060 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 4.1280 0.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -3.1000 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -2.4630 -1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 5.1810 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 5.6060 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 5.7870 0.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.5090 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.3020 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.7540 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -0.8830 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.9130 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 1.4460 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -1.1650 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 0.4190 -3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -0.1040 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 0.2430 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 2.3550 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.6980 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 4.8010 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 5.6620 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 4.6410 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 4.0210 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.4400 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -0.6390 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.3170 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 3.4020 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 2.0710 -3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 1.9740 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 2.3320 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8740 1.8140 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 5.7140 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8840 4.4010 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -4.0170 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 4.9460 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 6.6310 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 5.5500 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 23 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 17 24 1 0 0 0 0 17 25 2 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 26 1 0 0 0 0 24 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 M END > 247 $$$$ 248 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 0.1340 1.5280 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.0700 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.8420 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 1.9200 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.0660 1.9060 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1280 -0.4210 1.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7460 -1.2430 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -0.7830 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 1.3530 1.7760 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6220 0.3470 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 3.1310 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 2.7500 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3680 3.5270 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 0.6780 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6160 4.1400 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 3.7440 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -0.8890 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -2.2640 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 1.4640 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 3.7530 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6850 -0.4550 3.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -0.3220 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 0.7060 3.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 -1.4560 4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 2.1630 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 1.6790 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.2110 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.0560 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 1.7770 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 2.9740 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -0.6460 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -1.1440 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -2.2970 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 -1.4350 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 1.3040 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 3.0830 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 3.4690 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 2.7510 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 0.8970 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 1.5470 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6620 4.3000 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 4.3020 4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1700 3.5820 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -1.3690 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -1.4580 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 0.1250 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.2570 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.9540 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.5840 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.3960 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.7920 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 2.4870 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 2.8520 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 4.5840 4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 3.9860 4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1470 -2.1050 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -1.0540 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9760 -2.0300 5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 10 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 M END > 248 $$$$ 249 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 92 0 0 1 0 0 0 0 0999 V2000 1.3340 3.6890 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 2.3240 0.0840 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1980 1.2400 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 3.6380 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 2.6440 1.7220 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6870 1.2770 1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1440 0.2300 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 0.0820 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 2.5380 1.7150 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3510 1.4110 2.5660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9580 3.7600 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 3.8640 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 2.6160 2.6720 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8630 1.2970 2.3020 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4470 0.1220 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 0.0410 2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 2.4680 2.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5680 1.3720 3.3970 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0860 1.4960 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3350 2.9720 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 3.6460 2.8760 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6540 2.3800 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 1.3440 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 3.1880 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 1.6470 4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 1.6800 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 1.0040 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.1140 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 2.7230 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 2.8020 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 2.9670 -2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 4.7320 1.7910 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4120 4.1160 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9410 5.8170 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1750 6.8430 1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5060 5.7620 3.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 5.1570 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6700 4.0650 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 4.4190 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 4.0180 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.0580 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 3.3100 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 4.6260 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 0.9960 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 0.5110 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -0.7400 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -0.6830 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -0.2290 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 2.3400 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 3.6270 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4010 4.7060 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 4.6540 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 4.1380 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 2.8570 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 0.1730 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0220 -0.8060 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3490 -0.7610 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 -0.1720 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2700 2.2080 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5910 1.1940 4.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4120 0.8810 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9290 3.4180 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8410 3.0910 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 1.2790 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 0.5280 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 2.2970 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 3.5490 2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 2.3950 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 4.0090 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 0.8420 5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 2.5930 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 1.7000 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 0.8500 4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 2.6010 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 1.7780 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 1.8140 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1640 0.9220 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6040 0.0670 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -0.2120 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.9290 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.1550 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 2.5500 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 3.8140 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 2.1000 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3890 3.6480 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 3.3640 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 4.8960 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8040 7.5150 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 41 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 49 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 18 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 32 1 0 0 0 0 21 38 1 0 0 0 0 22 29 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 27 76 1 0 0 0 0 27 77 1 0 0 0 0 27 78 1 0 0 0 0 28 79 1 0 0 0 0 28 80 1 0 0 0 0 28 81 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 82 1 0 0 0 0 30 83 1 0 0 0 0 30 84 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 37 1 0 0 0 0 33 85 1 0 0 0 0 33 86 1 0 0 0 0 33 87 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 88 1 0 0 0 0 M END > 249 $$$$ 250 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.0400 1.5120 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3620 1.9240 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 1.2360 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.0040 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.0050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.7640 1.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0420 -2.1430 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -2.2560 -0.5070 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5690 -0.8200 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -0.5920 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.9660 -1.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.3990 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 1.9790 1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -1.8350 2.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -2.3740 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 0.0170 2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -1.0810 -1.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -0.8140 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -1.4850 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -0.0350 -3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 6.2000 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 5.8710 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 5.9810 2.4200 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0130 5.2590 2.4750 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7720 3.7470 2.4560 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9680 3.3810 1.2060 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2610 4.1100 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 5.5290 1.1700 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8780 7.3930 2.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 5.6190 3.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 3.0630 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8890 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 1.7250 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -0.8460 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -2.1550 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.9290 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -2.7480 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -3.0660 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 0.6790 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.6590 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -3.3760 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 -2.4220 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -1.7340 4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -2.1470 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 -0.7280 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -2.0650 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 5.8490 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 7.2810 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 6.2630 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 5.7360 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 5.5430 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 3.4560 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 3.6350 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 5.8110 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 7.7480 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 5.1980 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 2.0990 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 37 1 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 16 2 0 0 0 0 11 38 1 0 0 0 0 12 17 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 29 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 M END > 250 $$$$ 251 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4740 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.4530 -1.3290 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8750 2.4200 -1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2710 2.2120 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1760 3.6530 0.5360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3420 4.3490 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 3.6700 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.0750 -1.2830 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7730 1.2360 -1.6970 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0610 1.0500 -1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -0.1890 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -1.0190 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -1.8960 -1.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.3270 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -1.5300 -2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -3.8050 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -2.2620 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -0.5470 -1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.8390 1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 1.9900 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 3.6680 1.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 4.7270 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 4.0670 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.3880 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.4070 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 0.0090 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.5940 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 1.6680 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 4.1110 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 5.2760 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -0.0770 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 1.2210 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -4.3620 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -4.0750 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -4.0460 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -2.7790 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -2.7570 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 1.5030 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 1.6160 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 3.0800 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.6410 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 5.6860 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 4.6330 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 4.6680 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 5.0060 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 3.2890 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 4.1930 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 M END > 251 $$$$ 252 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 93 0 0 1 0 0 0 0 0999 V2000 1.2230 2.2800 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.8000 -0.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3280 0.0150 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 2.4470 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 1.7310 0.8770 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7980 0.2750 0.8580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3320 -0.3820 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.4230 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 1.8530 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 0.8820 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 3.2470 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 3.1600 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 0.6600 -0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 2.4730 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 0.6700 -2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.3180 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -1.4860 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 0.5290 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.7910 -2.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3370 2.4600 1.8210 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9520 1.0100 1.5740 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6610 0.3030 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 1.0160 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 2.3460 2.0460 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3290 3.5020 2.9270 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8180 3.3230 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2660 4.3910 4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8510 4.0560 5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2990 5.1240 6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5870 4.9310 7.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8120 5.0230 6.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9760 6.4110 5.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3600 7.5000 6.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 3.0090 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 4.8270 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 0.4920 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 2.3450 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 2.7920 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 2.7310 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 0.3820 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 2.0180 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 3.5090 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -0.1990 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 0.1620 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -1.4090 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -0.6820 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -1.2050 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 2.9040 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 4.3070 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 3.3490 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 3.9680 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 2.5730 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 1.9120 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 3.4630 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.0850 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.1420 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.3970 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -1.7340 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.0900 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -1.6890 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.3480 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 0.5590 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -0.4210 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 0.4210 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -0.7600 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 1.2000 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 0.4110 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 3.5080 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 2.3410 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3900 3.4060 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1040 5.4330 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0140 3.0140 5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8330 3.9500 8.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9100 5.7040 8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5090 5.0040 7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3190 5.1600 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1350 5.7950 7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0580 4.0410 6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0800 8.4410 6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8540 7.4120 7.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4390 7.4770 6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 2.9120 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 2.4450 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 4.0600 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5520 4.7650 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 5.0260 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 5.6330 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 1.0910 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 0.5660 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -0.5490 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 18 63 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 23 24 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 25 68 1 0 0 0 0 26 27 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 28 2 0 0 0 0 27 71 1 0 0 0 0 28 29 1 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 33 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 88 1 0 0 0 0 36 89 1 0 0 0 0 36 90 1 0 0 0 0 M END > 252 $$$$ 253 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 68 68 0 0 0 0 0 0 0 0999 V2000 0.0140 1.0550 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.4410 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.7850 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.3040 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -2.6480 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -4.1670 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -4.5110 3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -6.0300 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -6.3740 5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -7.8930 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -8.2320 7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -8.8880 7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -9.1640 6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -10.6660 6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -10.9460 6.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -12.4480 6.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 3.3260 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 3.9330 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 3.1360 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 1.6610 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 1.8520 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 1.3060 -0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 3.6820 -1.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 4.0620 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 5.4290 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 0.9250 -1.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 0.8700 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 4.1050 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 0.1560 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 1.3940 -3.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -0.8200 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.8990 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.4070 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.3270 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -2.6820 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.7620 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -2.2700 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.1900 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -4.5450 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -4.6250 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -4.1320 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -4.0530 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -6.4080 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -6.4880 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -5.9950 6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -5.9160 6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -8.2710 5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -8.3510 5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -7.9340 7.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -9.2310 8.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -8.6250 7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -8.8340 5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -11.2050 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -10.9960 7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -10.4070 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -10.6160 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -12.9870 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -12.7780 7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -12.6480 5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 5.9050 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 5.6920 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 5.7710 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 4.6540 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 3.0890 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 4.6040 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -0.2500 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -0.6570 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 0.8570 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 2 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 2 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 24 28 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 27 29 1 0 0 0 0 27 30 2 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 M END > 253 $$$$ 254 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.2540 1.5020 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.0020 0.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7120 -0.7940 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 1.8460 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.1260 1.5480 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1510 -0.3710 1.4480 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8250 -1.0870 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.9060 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 1.4040 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 0.4280 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 0.7120 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6040 1.9420 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 2.9160 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 2.6430 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -1.8240 2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.3140 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -0.2860 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -0.6020 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -0.0070 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.6870 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 2.2450 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 4.1380 0.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 5.0910 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 1.7120 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -0.7060 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.2780 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 2.0300 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.8290 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.2920 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 1.5340 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 2.9240 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -0.6640 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -2.1530 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 -0.0430 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 3.4100 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 0.1070 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -0.5290 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -1.6140 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -1.1970 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -1.1500 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 0.3640 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 1.9850 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 3.3080 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 1.6630 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 4.7000 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 5.2760 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 6.0230 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.6790 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 1.1280 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 2.7450 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.3890 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -2.8930 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -2.5980 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 29 1 0 0 0 0 3 6 1 0 0 0 0 3 20 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END > 254 $$$$ 255 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 64 0 0 0 0 0 0 0 0999 V2000 0.0160 1.2860 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.0460 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.7950 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -0.0880 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.2430 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 1.9930 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.1920 0.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -1.9940 -0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 1.9770 0.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.7640 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -0.7800 -0.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.6780 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 -1.7730 1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -2.5660 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 2.9300 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 1.9600 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 2.5260 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 3.2540 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 3.8200 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 4.5480 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4890 5.1140 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 5.8420 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 6.4080 -5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4830 7.1360 -5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7850 7.7020 -6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1310 8.4300 -6.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4330 8.9960 -8.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7780 9.7240 -8.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -0.6930 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.8120 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.3050 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -2.3360 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.3940 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -3.6100 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 2.4120 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 3.4730 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 3.6320 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 2.7740 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 1.2600 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 1.7120 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 3.2260 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 4.0680 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 2.5540 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 3.0060 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0560 4.5200 -2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1450 5.3620 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 3.8480 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5310 4.3000 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 5.8140 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7930 6.6560 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 5.1420 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1790 5.5940 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3520 7.1080 -5.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4410 7.9500 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2680 6.4360 -5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8270 6.8880 -7.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 8.4020 -6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0890 9.2440 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9160 7.7300 -6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4750 8.1820 -8.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6470 9.6960 -8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7360 10.5380 -7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5640 9.0240 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9940 10.1270 -8.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 9 15 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 M END > 255 $$$$ 256 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.1560 1.0500 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.4650 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -1.1630 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 1.5530 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 0.9340 1.6370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9940 -0.5820 1.5640 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8300 -1.1800 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -0.9290 2.3310 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5310 1.3460 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 0.4970 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 3.1830 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 2.7380 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 2.3170 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 0.9510 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 1.4800 2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -1.1220 2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.8690 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -2.6490 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.5460 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 0.1740 2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 2.7520 1.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3670 2.6060 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 1.8780 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 2.3720 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -1.8110 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -3.0760 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 4.4520 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5700 1.7100 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 0.7500 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 2.1650 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5070 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.3440 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.8110 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.7330 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 1.2770 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 2.6390 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -0.7240 3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -2.2570 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -1.1320 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 1.3350 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 0.9500 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 2.5430 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -1.7330 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.5120 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -0.0930 2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.7160 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -3.1950 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -3.0820 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 3.7950 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 2.9210 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 3.2290 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 1.5640 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 0.8500 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 1.9130 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9200 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -3.6160 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -3.6570 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 4.9930 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5420 2.1250 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4610 1.5110 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9830 3.1880 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 27 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 20 2 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 M END > 256 $$$$ ATCMD MOE2008 3D 75 77 0 0 1 0 0 0 0 0999 V2000 5.3370 -1.6360 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -2.2130 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 4.4310 -0.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 3.9820 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -3.8770 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -3.6280 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -3.7630 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -4.9230 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.7660 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -3.0190 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -1.7460 -1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -3.4240 -0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.9420 -0.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7270 -1.5750 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 3.2000 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 3.9270 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 3.6700 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 1.8080 0.2570 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2160 0.1700 0.6440 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5660 0.4640 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 0.6350 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -0.0990 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 1.8200 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.2690 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 2.4900 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 3.4200 -1.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5430 3.8500 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -0.4080 -1.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6590 2.1880 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 1.0550 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 1.9060 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -0.6940 -0.8960 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7740 -1.6550 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.4400 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 0.1260 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 0.4630 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 2.9440 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 2.6860 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 3.9370 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 3.0070 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 1.2910 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 1.6250 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 2.0120 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 0.3850 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 1.1810 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 0.9700 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 0.4510 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 2.1430 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 0.3090 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -0.3930 0.2590 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4740 0.1050 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -0.6270 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -0.8230 0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 2.3240 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 1.7270 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 2.3110 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 3.3550 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -1.4650 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -2.0070 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -1.6300 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -1.4430 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8610 -3.1460 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 -2.9890 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -2.9420 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 -4.2030 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -2.2420 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -1.2090 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -2.5270 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -2.2880 -0.0050 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8550 -1.8450 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -3.7040 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -4.1620 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -3.7030 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -4.3410 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -1.3480 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 50 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 54 1 0 0 0 0 19 49 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 41 1 0 0 0 0 30 45 1 0 0 0 0 31 34 1 0 0 0 0 31 37 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 53 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 52 58 2 0 0 0 0 53 61 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 61 69 1 0 0 0 0 61 75 2 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 62 65 1 0 0 0 0 62 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 1 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 71 72 1 0 0 0 0 71 73 1 0 0 0 0 71 74 1 0 0 0 0 M END > 257 $$$$ 258 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.4040 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 0.6710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 1.7840 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.8810 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -2.2200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -0.4010 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 0.6450 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 0.6280 1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 0.6040 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 0.5860 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 0.5970 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 1.9950 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 2.8050 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -2.7580 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -0.2480 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 1.5310 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -0.4460 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9840 1.0830 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 1.1080 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 M END > 258 $$$$ 259 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.8710 1.3720 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 2.2330 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 1.6590 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 0.3650 0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -0.0820 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.5210 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.8860 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.7850 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.3380 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.0000 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -4.1170 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -4.7220 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -6.2180 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -4.0680 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 1.8320 0.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 2.5260 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 3.6820 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 4.1120 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 5.4620 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 6.3890 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 5.9680 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 4.6200 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -2.2430 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -3.0520 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -0.6560 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -6.6950 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -6.4720 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -6.5660 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 2.9430 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 1.9260 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 3.3360 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 3.3900 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 5.7960 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 7.4440 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 6.6960 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 4.2930 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 15 2 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 M END > 259 $$$$ 260 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0010 1.5450 0.0080 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3190 1.3900 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 2.2060 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 0.0560 -0.5800 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2940 0.0560 -0.1550 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2590 -0.7240 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.8190 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -1.1130 0.1450 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7820 1.7480 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.1260 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -0.6040 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -1.0590 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.0850 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -2.0850 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 1.7820 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 3.2020 1.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 3.5810 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 5.0380 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 2.7530 3.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 3.2190 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.0780 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -1.1740 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -2.1590 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.6560 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -0.7460 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 2.1660 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 2.4840 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 0.8530 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 0.8320 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -0.5990 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -1.4660 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 0.1110 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.9260 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.0990 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 1.6530 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 3.1700 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 1.8170 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -2.5050 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -1.5530 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -2.8890 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 1.2420 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.4250 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 5.6280 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 5.1790 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 5.3620 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 14 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 M END > 260 $$$$ 261 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.6290 1.7220 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 2.3680 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 1.8430 2.0170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3660 0.3260 1.9510 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0970 -0.2790 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 2.2590 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 0.0760 4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.1230 4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.1860 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 0.2230 0.2930 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0120 -0.2430 1.7160 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1160 -1.7650 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -1.9520 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -0.6340 -0.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6490 -0.1220 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 0.1030 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 2.4570 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 0.1310 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 1.2780 6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -1.3820 -0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 0.7340 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 3.9030 2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 4.5980 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 4.0180 2.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 6.1030 2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -0.9170 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -1.8600 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.3960 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 1.9820 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 2.0730 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 2.1190 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 3.4500 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.1280 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 3.3020 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.6590 2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -0.5650 4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 2.8920 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -2.1620 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.2360 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -2.7870 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -2.1300 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -0.1360 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 2.0850 3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 2.1810 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 0.4530 6.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 2.2250 6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.2230 6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -1.5550 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 6.4430 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 6.4280 3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 6.5240 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -1.3840 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -2.0620 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.7950 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -1.3940 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 1.0170 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 0.1830 -3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 0.9220 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 16 1 0 0 0 0 5 7 2 0 0 0 0 5 33 1 0 0 0 0 6 8 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 9 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 26 1 0 0 0 0 14 42 1 0 0 0 0 15 20 1 0 0 0 0 15 21 2 0 0 0 0 17 22 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END > 261 $$$$ 262 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -0.0660 1.5350 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 2.1840 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 1.2640 0.0560 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2690 0.1380 1.0700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3590 0.7070 2.5070 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8050 2.0100 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 0.7650 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 2.7460 1.6550 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5170 1.7860 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0390 -0.1320 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8810 -0.4240 1.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6540 -1.9400 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -1.9670 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.6110 0.3620 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0300 -0.6320 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 0.6010 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.0820 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -0.8350 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -1.7100 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 0.5130 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -0.6180 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 0.0530 -2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -1.9480 -1.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 1.9930 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 1.6280 -2.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 1.2160 -3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 0.0360 -3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 2.2260 -4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 1.9790 2.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 3.1020 2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.9430 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8300 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 2.7540 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 2.9550 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 0.0200 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 1.2770 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 2.7270 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 0.0000 3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 3.6400 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.4250 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.3950 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.7870 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -2.0730 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 0.0220 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 0.0160 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -0.0540 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.3330 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -1.8700 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -2.6700 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -1.2120 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 1.0990 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 0.3480 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 1.0530 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -2.3240 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 1.1880 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 1.9920 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 2.9490 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 3.2310 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 2.1230 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 2.0530 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 15 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 5 35 1 0 0 0 0 6 8 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 9 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 39 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 18 1 0 0 0 0 14 44 1 0 0 0 0 16 25 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 M END > 262 $$$$ 263 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.2250 1.7120 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 2.1500 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.2880 1.1690 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7760 0.3080 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 1.7680 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 1.8380 1.4440 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1270 0.2180 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.3770 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -1.8260 -0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -0.2120 -0.5980 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4900 -0.1480 0.6500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1030 -0.5980 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -1.7100 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -1.6620 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -0.7990 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 1.2990 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 1.0690 2.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 3.2950 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -2.4950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -2.5120 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -1.9230 -0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -4.0190 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 2.0620 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 2.1500 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 2.0090 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 3.2000 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 0.2450 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -0.2910 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.1530 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 2.3630 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.0770 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -0.0210 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 0.3990 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -1.6590 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -2.7480 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -1.1860 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -1.2300 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -2.0670 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 1.3630 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 3.3460 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 3.6920 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 3.8840 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.4610 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -3.5280 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -2.0900 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -4.3670 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -4.4160 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -4.3610 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 19 1 0 0 0 0 14 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 M END > 263 $$$$ 264 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8310 -4.0940 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.8370 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -2.2240 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -2.0330 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4240 -2.1690 0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -1.6490 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -2.1610 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -4.5570 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -4.3740 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -5.9130 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -1.5740 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 -0.6870 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -2.4080 2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 3.9460 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 3.9370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 3.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 M END > 264 $$$$ 265 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 76 0 0 1 0 0 0 0 0999 V2000 0.7470 2.6120 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 1.2910 1.7280 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9380 0.1180 2.4220 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2620 2.7190 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 1.5470 2.8180 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4460 0.2340 2.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1640 -0.9010 2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -0.8480 2.9340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4610 1.6420 2.6780 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1250 0.5160 3.4720 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4180 3.1680 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 3.0020 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 1.9930 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 0.6030 3.3180 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0340 0.3130 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 2.1780 4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 3.4820 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6480 3.7140 5.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 5.0240 5.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2480 5.1000 6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3470 4.1490 6.6440 N 0 0 3 0 0 0 0 0 0 0 0 0 13.3040 4.1940 7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 0.6010 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 1.5770 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 1.1920 1.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 0.1540 3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -1.2000 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.2240 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 1.5570 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -1.8830 3.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.8150 3.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.6890 4.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.9430 4.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 1.6840 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 1.6170 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 2.1820 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -0.5970 6.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5080 4.3500 3.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 3.4420 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 2.6530 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 1.2580 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 2.6860 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 3.6570 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -0.9900 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 3.1840 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 4.0970 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 3.7960 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 3.0640 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -0.1270 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 1.0460 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 0.3760 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -0.6880 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 1.3710 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8160 5.1870 4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5070 5.7910 5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6510 6.1100 6.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 4.8510 7.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9940 3.2130 6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7210 5.1980 7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7940 3.9380 8.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1070 3.4800 7.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 1.8220 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 0.5990 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 2.3300 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.2260 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -2.0340 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -1.2790 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -2.7750 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 1.1380 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 2.6250 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 1.0380 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -1.3310 6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 0.4040 6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -0.7940 6.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 41 1 0 0 0 0 3 6 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 31 2 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 14 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 38 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 34 1 0 0 0 0 26 32 1 0 0 0 0 26 33 2 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 30 68 1 0 0 0 0 32 37 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 M END > 265 $$$$ 266 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 1.4840 2.8750 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 1.6910 -0.1920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6920 0.5220 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 2.4490 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 1.3640 1.7050 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1040 0.1870 1.2290 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1660 -0.9360 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -1.4690 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 0.8990 1.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5840 -0.3740 2.6800 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6800 1.5370 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 2.0150 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 0.2820 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 -0.8560 2.5410 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3680 -1.9260 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8560 -2.2840 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 -0.0750 2.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7080 -1.0360 3.7990 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1840 -1.4240 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0570 -0.1810 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8260 0.8050 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3450 1.1730 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 2.1050 -0.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 1.9900 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -0.0800 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -1.4960 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2900 -0.3950 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6310 2.0820 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3130 0.2060 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 2.5900 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 3.0390 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 2.6680 -2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 -1.0840 6.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 0.7390 5.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.8020 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.6960 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 3.6630 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 3.2860 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.3570 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 2.0430 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 3.3060 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -0.2090 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.5940 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -1.7580 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.3070 2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -1.8240 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 0.7100 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 2.2890 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 2.8840 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 2.3230 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -1.6610 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -2.8400 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 -3.0080 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1290 -2.7280 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7530 -0.5840 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3310 -2.0740 4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4640 -1.9790 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8590 0.3100 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1110 -0.4860 4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 1.8140 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 1.7400 3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 2.5550 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.2040 3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 2.6580 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -0.9650 4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 0.7490 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 0.1850 4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -0.7560 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 -1.8470 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -2.3370 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6900 1.8360 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4760 2.7960 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2960 2.5200 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 -0.7130 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 0.9190 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3780 -0.0140 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 4.0950 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 2.8920 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 2.4540 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0990 -0.6300 7.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 0.8200 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.0200 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.7680 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.9080 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -1.5650 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.4720 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 21 29 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 30 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 33 1 0 0 0 0 27 34 2 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 33 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 M END > 266 $$$$ 267 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 89 0 0 1 0 0 0 0 0999 V2000 1.8720 2.6840 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 1.4170 0.2240 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2830 0.3390 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 2.3640 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 1.3690 1.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7470 0.1130 1.6040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9720 -0.9070 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -1.3780 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 0.9700 1.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3870 -0.2060 2.8000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3740 1.7880 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 2.1190 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 0.5200 2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 -0.6420 2.5490 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2340 -1.7520 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7400 -2.0100 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.7260 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.6750 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 2.0540 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 -0.2070 5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 0.2500 4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -1.2340 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.9670 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 2.0930 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 2.4290 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 2.1540 -2.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2710 0.3210 2.7860 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5010 -0.7410 3.8550 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9910 -1.0410 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6190 -1.4400 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4150 -0.3480 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9220 -0.0690 1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 3.2580 2.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1530 0.9270 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9800 -0.8400 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 1.2740 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 3.4150 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 3.1250 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 1.0310 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 1.9190 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 3.2790 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -0.3390 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -0.4890 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -1.7780 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -2.1100 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -1.8690 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 0.7020 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 2.5830 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 -1.5840 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 -2.6830 3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 -2.7940 4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 -2.3520 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 0.6070 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -0.0300 3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 1.6870 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 2.5940 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 1.3040 3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 2.7540 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 -0.9600 5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5360 0.7000 5.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 0.0180 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -0.5610 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 1.1170 4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 0.5160 4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -0.4440 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -1.6760 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -2.0010 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -1.2220 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.7750 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.8220 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 3.4930 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 2.1840 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 1.8520 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4940 -0.1680 4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1050 -1.8670 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6910 -1.6070 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1680 -2.3700 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -0.9710 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7920 0.7400 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2180 0.7170 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9960 1.6940 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7700 1.2800 2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -1.7470 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8410 -0.0690 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0440 -1.0530 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 47 1 0 0 0 0 10 14 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 48 1 0 0 0 0 12 33 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 28 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 24 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 28 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 25 73 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 36 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 30 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 35 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 M END > 267 $$$$ 268 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.4650 1.4390 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 1.8220 0.1230 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6070 -0.3270 -1.1240 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8000 1.1920 -0.9620 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5950 -1.3000 -5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.3090 -4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 0.0110 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -0.7100 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.0570 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1450 -0.6250 -1.1700 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6310 -2.0670 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.8190 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6460 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -1.4900 -7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -2.5690 -7.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -2.6920 -9.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 0.4950 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -2.7210 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -0.0200 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.1720 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.6400 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 1.5570 1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 2.5480 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 3.6020 2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 2.3440 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -1.0980 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 1.4680 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -0.6750 -7.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -3.7560 -1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 1.8360 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.8740 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 2.9210 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 1.6710 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -1.9640 -5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 1.0860 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.3210 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -0.4140 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -1.7870 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.5510 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -2.6520 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -3.6020 -9.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -1.8280 -9.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -2.7400 -9.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 1.2810 -6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.9440 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -0.1590 -5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -2.4670 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -0.6640 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.1050 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 0.9540 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.3270 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -1.7280 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -0.2810 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 2.6470 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 2.9470 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 1.2920 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -2.1640 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -0.9220 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -0.7600 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 1.0910 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 0.9670 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 2.5410 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 28 2 0 0 0 0 15 16 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 29 2 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 M END > 268 $$$$ 269 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.5510 1.0510 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 1.5310 0.3770 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5650 -0.4620 -1.0890 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6470 1.0540 -0.9100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8500 -1.2860 -5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -0.2990 -4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.0300 -3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.7540 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -1.4490 -7.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.5180 -7.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -2.6130 -9.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 0.5500 -5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.5970 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.1160 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 1.1540 1.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 2.0220 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 3.0620 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 1.6970 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -1.1620 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 1.4800 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -0.6190 -7.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -0.4610 0.3540 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1550 -0.9700 -0.8840 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0630 -2.4970 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.8520 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.9710 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.8700 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -0.0170 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -3.8510 -1.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 1.3670 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.5290 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 2.6390 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.5330 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.9680 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.0420 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.3920 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -0.4010 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -1.8270 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -1.7410 -9.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -2.6520 -9.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.5170 -9.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 1.3400 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 0.9940 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -0.0710 -6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.8410 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -2.1990 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -0.7740 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 0.7240 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 2.4600 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 1.6720 4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -2.2420 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -0.8520 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -0.8920 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 1.1070 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 1.0670 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 2.5680 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -2.8680 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.9720 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -2.2240 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 0.7350 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -0.6440 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 0.4750 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 19 1 0 0 0 0 3 23 1 0 0 0 0 4 20 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 23 1 0 0 0 0 14 22 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 M END > 269 $$$$ 270 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 1.6050 -1.3060 2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.4610 2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -3.2740 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -2.9080 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -3.7810 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -3.6230 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -4.3960 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -2.9780 1.5840 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4880 -2.5880 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -4.1370 -6.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -4.9900 -6.5860 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5040 -6.1260 -5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -3.5780 -4.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -4.7380 -3.9390 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2820 -5.6370 -4.1540 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2950 -6.7590 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -6.1220 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -4.1500 -2.5300 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3500 -5.1680 -1.4190 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2690 -2.4480 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -3.1900 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 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1.0650 -3.7210 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -6.0810 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -5.5220 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -4.0210 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -4.7020 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -5.6820 -5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -6.3830 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -4.8160 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -6.5870 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -5.3600 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -6.6980 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -2.8570 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -3.0260 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -4.2330 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -7.7120 -6.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -8.0180 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -6.8710 -6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6570 -5.8790 -5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -7.4920 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 -7.0390 -6.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -5.0160 -10.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -4.9920 -10.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 -6.4500 -10.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 38 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 22 1 0 0 0 0 8 25 1 0 0 0 0 8 47 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 53 1 0 0 0 0 12 15 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 19 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 23 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 35 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 M END > 270 $$$$ 271 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.2620 1.5240 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.0220 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.7700 1.2400 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7510 1.8670 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.1500 1.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1610 -0.3470 1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8360 -1.0580 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -0.8790 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 1.4280 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 0.4560 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 0.7410 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 1.9840 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 2.9440 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 2.6680 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 2.2950 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 3.3140 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 2.8760 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 1.0780 1.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 1.1830 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 2.2580 1.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0220 -0.0380 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -1.7960 2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 1.7410 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -2.2330 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.6610 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -2.8450 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -2.8410 0.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 2.0470 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 1.8550 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 2.1670 2.7750 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -1.1700 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -1.1260 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 0.3890 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -3.7720 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 22 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 26 1 0 0 0 0 24 27 2 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 M END > 271 $$$$ 272 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.1780 0.8850 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.6170 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -0.9720 -1.5100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1540 1.6280 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 1.3530 -1.3420 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2080 -0.1410 -1.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0330 -0.4150 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 0.3030 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 2.0400 -1.1740 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5220 1.0360 -1.2950 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8540 1.7810 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 2.5710 0.0370 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8130 3.5250 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 2.7720 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.8580 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 2.0080 -2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 2.7720 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 3.3880 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.4570 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 1.6190 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 4.6940 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 0.2870 -3.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 0.3180 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -3.2780 -1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -4.6020 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -5.0590 -1.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -5.5170 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.2130 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 1.1040 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.9280 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.1520 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 2.6980 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 1.2880 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.4950 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -1.4830 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -0.0400 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 1.0610 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 2.4660 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 4.0290 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 4.2760 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 3.4960 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 2.0650 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.1270 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.9980 -3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -1.6240 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 3.0920 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 1.7250 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 1.6740 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 2.8950 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -2.7630 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -2.5810 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 0.9750 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1870 2.1960 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 1.0070 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 5.1880 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 5.2770 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.9290 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -6.2340 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -6.0520 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 22 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 18 21 2 0 0 0 0 18 49 1 0 0 0 0 19 24 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 M END > 272 $$$$ 273 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.6170 0.8470 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.5140 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -1.1140 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 1.5900 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 0.9910 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -0.3650 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -1.0850 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -0.1220 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 1.8340 0.1000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4380 0.9860 0.2500 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3950 3.9630 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 3.0800 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -1.2550 0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6610 3.1670 0.7800 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6200 1.8610 -0.0360 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0320 1.3190 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 2.6120 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 3.7890 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 2.9610 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 4.9510 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -2.0160 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -2.8000 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.0730 2.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 0.3240 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 2.1320 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 2.1800 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.3250 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.1730 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 2.6490 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -1.7670 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -1.6880 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -0.6530 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 0.3380 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 4.2620 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 4.8550 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 3.6560 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.8190 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 0.9250 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 0.5710 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6880 2.6480 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 2.6260 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 2.5500 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 2.2680 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 3.9170 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -2.6250 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -3.8630 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -2.4800 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -0.2300 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 1.0880 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -0.3600 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 6 2 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 15 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 20 2 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 M END > 273 $$$$ 274 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 0.8940 2.4040 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 0.2460 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 0.9150 0.5650 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3240 5.7420 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 6.7820 2.0370 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9660 7.6010 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 4.8120 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 5.6300 0.7980 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7490 6.7130 1.8600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4440 7.4920 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 6.5220 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 4.7260 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 2.4280 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 3.4350 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 3.1100 0.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1890 4.3920 1.3280 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2310 4.7130 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 3.3130 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.1210 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -5.7410 3.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -4.4300 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -3.9470 4.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 8.6490 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -1.2300 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 0.3830 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 8.3640 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 6.1950 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 5.3970 1.0200 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4460 -3.5610 2.5400 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3860 -1.6990 0.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 4.0600 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -4.0770 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 7.6830 1.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 5.8610 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 3.4520 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5140 7.3440 2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 6.3290 3.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7320 8.2290 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 0.6880 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 0.3950 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 0.6910 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 5.1370 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 6.2210 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 6.2780 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 4.3240 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 4.0590 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 6.1740 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 7.8580 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 8.3240 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 7.0660 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 6.1310 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 2.0750 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 1.5680 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 3.0430 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 5.1720 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 5.3470 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 3.0970 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -1.7830 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -2.0760 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -6.2580 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 9.3880 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 9.1440 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 8.1650 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.6960 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 0.6070 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 0.8600 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 7.6490 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 8.9660 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 9.0130 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 6.7360 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 6.8740 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 5.3770 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -3.5910 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 3.6340 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 3.3380 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 4.9690 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -3.4490 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -5.1030 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -4.0470 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 4.1300 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 3.9330 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 2.5380 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0520 8.3140 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5350 7.7940 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4880 9.2180 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 15 1 0 0 0 0 1 18 2 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 25 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 44 1 0 0 0 0 6 9 1 0 0 0 0 6 23 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 28 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 14 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 19 24 1 0 0 0 0 19 29 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 60 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 30 2 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 34 1 0 0 0 0 29 32 1 0 0 0 0 29 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 33 36 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 M END > 274 $$$$ 275 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -1.1030 0.8740 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 1.5530 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 0.8270 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.5040 -0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -0.5480 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -1.1960 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.6990 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -3.3030 -1.3660 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2610 -2.7290 -0.4140 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4410 -1.2470 -0.7380 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1460 1.4930 -0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 1.5260 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.5600 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 2.2590 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 3.6420 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 4.2830 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 3.5420 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9480 2.1640 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 1.5220 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -0.6300 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 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0 0 0 0 0 0 0 0 0 3.2540 0.9880 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 2.5450 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 2.0980 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 0.5410 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 5.3600 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 4.0410 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 1.5860 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 0.4460 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -7.2860 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -7.3910 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -7.2760 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -4.6010 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 -5.0820 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -3.5480 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 0.2280 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 0.9550 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 -0.7140 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 5.4970 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 4.4800 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 6.0440 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 2 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 6 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 40 1 0 0 0 0 10 20 1 0 0 0 0 10 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 20 29 1 0 0 0 0 21 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END > 275 $$$$ 276 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.6050 0.0760 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -1.3980 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -1.5510 -2.6280 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7410 0.7300 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 0.6590 -1.9890 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8120 -0.7800 -2.4690 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6550 -0.8210 -3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -0.3200 -3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 1.1480 -1.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9720 1.0350 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 2.0180 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 3.3900 -2.5940 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3240 3.2700 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 2.5240 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -1.1640 -3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 1.5740 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 4.2770 -3.3140 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9590 4.3080 -4.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -3.0560 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.3060 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 0.4480 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 4.0110 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 3.8760 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 5.6960 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 6.4960 -3.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -3.8190 -2.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -5.1520 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -5.6630 -2.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -6.0100 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 0.5810 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 0.1500 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -1.8920 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -1.8790 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 1.7740 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 0.2110 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -1.8510 -4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.2160 -4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -1.0290 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -0.2260 -4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 1.8440 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 2.7250 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 4.2680 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 3.1200 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 2.4060 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -0.1670 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -1.1690 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -1.8800 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.6100 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 1.4520 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 1.3130 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 4.6880 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.2220 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -3.3770 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 4.0820 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 5.0070 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7980 3.3850 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 5.6620 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 6.1300 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 7.4100 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -5.3770 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -6.5590 -4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -6.7150 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 10 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 18 51 1 0 0 0 0 19 26 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 M END > 276 $$$$ 277 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.1940 1.0500 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.4690 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -1.1360 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 1.5680 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 0.9930 1.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0160 -0.5240 1.5680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9040 -1.0970 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.8020 2.2640 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4990 1.4550 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 0.6390 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 1.1500 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 2.5390 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 3.3670 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 2.8620 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 3.6340 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 0.4070 2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -1.1080 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.6230 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 1.5370 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 4.6540 0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 3.0410 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2540 2.8930 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4030 2.2260 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -1.6580 1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -2.8770 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -3.7780 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -3.2520 2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 1.4740 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.3690 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -0.8220 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.7650 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 1.2580 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 2.6560 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -0.8080 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.6430 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -2.1780 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -1.0150 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -1.7510 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.4670 3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.0870 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.6870 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -3.1490 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -3.0800 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 1.3610 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 1.0300 3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 2.6080 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 5.1650 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 4.0920 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 1.8420 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2810 3.2560 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 3.4740 3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 1.1750 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 2.3310 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4300 2.5890 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -3.6000 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -4.8190 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -3.5670 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 M END > 277 $$$$ 278 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 92 0 0 1 0 0 0 0 0999 V2000 -0.2190 0.9550 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -0.4540 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 2.9160 1.3930 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6460 3.4040 1.5610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4160 3.1450 0.2620 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3420 1.6540 -0.0770 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9730 1.2590 -0.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.4340 1.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4960 3.0860 2.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 4.8040 1.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 3.5290 0.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 1.4140 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -0.1060 -3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 0.0320 -1.6720 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3700 -0.5480 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -1.5800 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -2.0670 -3.0550 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0510 -1.4730 -1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 -1.9880 -1.0740 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2380 -3.5160 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -3.5960 -2.9520 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0070 -4.0760 -2.4170 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3980 -5.7020 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-0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -3.8090 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -5.9870 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -6.1230 -5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -3.8090 -4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -3.8890 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 -6.1380 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -5.7470 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -8.1470 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 -8.2960 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -8.0720 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 -0.5890 -4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 -2.0130 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 -2.1350 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 -5.6370 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 -5.0730 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -6.5390 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5700 -6.6700 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3610 -8.9810 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 -10.3050 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3190 -8.2700 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 -0.0290 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6910 -0.8670 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1170 -1.7400 -2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 8 53 1 0 0 0 0 9 54 1 0 0 0 0 10 55 1 0 0 0 0 11 56 1 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 59 1 0 0 0 0 15 18 2 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 61 1 0 0 0 0 16 62 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 63 1 0 0 0 0 20 22 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 26 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 34 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 27 29 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 29 1 0 0 0 0 28 35 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 32 78 1 0 0 0 0 33 43 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 82 1 0 0 0 0 37 38 1 0 0 0 0 37 83 1 0 0 0 0 38 39 1 0 0 0 0 38 41 2 0 0 0 0 39 40 1 0 0 0 0 40 84 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 85 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 M END > 278 $$$$ 279 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 107113 0 0 1 0 0 0 0 0999 V2000 3.8070 -0.4380 3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -1.8260 3.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 1.2730 2.1730 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2930 1.5290 1.0360 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6310 1.1690 -0.2970 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1660 -0.2890 -0.2500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2680 -0.4660 0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 -0.1890 2.1250 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9290 1.5370 3.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 2.9090 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 1.3350 -1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -0.6160 -1.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 -2.6440 -2.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0140 -4.1210 -2.7130 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6410 -4.2290 -3.3810 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6610 -3.5940 -2.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -2.2010 -2.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2360 -2.0110 -1.6330 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9920 -4.8100 -1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 -2.5370 -1.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -1.6250 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -3.5860 -4.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -2.5020 -6.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -3.7270 -5.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5640 -4.9560 -6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.7280 -7.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -3.9220 -8.1080 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0260 -5.0370 -7.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -6.3380 -8.2260 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7830 -6.7870 -8.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -4.4430 -8.5980 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1200 -5.6680 -9.4860 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1380 -3.8400 -9.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -3.3460 -9.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -5.0680 -10.7810 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1780 -6.1630 -10.0790 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1450 -6.7100 -9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -5.7040 -10.8840 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5100 -6.7290 -9.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.4560 -9.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -5.3930 -10.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -7.2080 -11.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -6.1260 -9.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -4.7060 -12.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -6.3960 -12.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -5.6690 -13.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -6.3170 -14.5310 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5.7700 -4.5660 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -5.2800 -3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -1.6840 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -2.4940 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -5.7520 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 -2.9240 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -2.1920 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -0.5810 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -1.6910 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -1.6130 -5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -2.3740 -6.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -3.8140 -4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -5.8130 -5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.9080 -6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.8390 -7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -7.0990 -7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -7.6780 -9.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -7.0150 -7.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -4.1030 -9.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -3.0450 -10.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.4460 -8.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -3.1250 -10.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -7.7170 -8.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -6.0460 -8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -4.9370 -10.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -7.7230 -10.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 -6.4440 -9.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -3.0590 -9.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -4.3000 -10.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.6790 -9.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -7.9670 -10.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -4.2760 -12.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -5.6040 -12.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -3.9800 -12.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -4.6140 -13.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -5.7820 -15.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -8.2650 -11.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -6.0110 -11.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -7.2340 -10.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -7.7330 -11.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 56 1 0 0 0 0 1 57 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 60 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 62 1 0 0 0 0 7 8 1 0 0 0 0 8 63 1 0 0 0 0 9 64 1 0 0 0 0 10 65 1 0 0 0 0 11 66 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 20 1 0 0 0 0 13 67 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 68 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 69 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 70 1 0 0 0 0 18 71 1 0 0 0 0 19 72 1 0 0 0 0 20 73 1 0 0 0 0 21 74 1 0 0 0 0 21 75 1 0 0 0 0 21 76 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 77 1 0 0 0 0 23 78 1 0 0 0 0 24 25 1 0 0 0 0 24 79 1 0 0 0 0 25 28 2 0 0 0 0 25 80 1 0 0 0 0 26 27 1 0 0 0 0 26 81 1 0 0 0 0 26 82 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 43 1 0 0 0 0 29 83 1 0 0 0 0 30 32 1 0 0 0 0 30 84 1 0 0 0 0 30 85 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 52 1 0 0 0 0 32 36 1 0 0 0 0 32 41 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 86 1 0 0 0 0 33 87 1 0 0 0 0 34 88 1 0 0 0 0 34 89 1 0 0 0 0 35 36 1 0 0 0 0 35 38 1 0 0 0 0 35 44 1 0 0 0 0 36 37 1 0 0 0 0 36 42 1 0 0 0 0 37 39 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 38 39 1 0 0 0 0 38 45 1 0 0 0 0 38 92 1 0 0 0 0 39 93 1 0 0 0 0 39 94 1 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 42 98 1 0 0 0 0 43 53 1 0 0 0 0 44 99 1 0 0 0 0 44100 1 0 0 0 0 44101 1 0 0 0 0 45 46 1 0 0 0 0 45 50 2 0 0 0 0 46 47 2 0 0 0 0 46102 1 0 0 0 0 47 48 1 0 0 0 0 47103 1 0 0 0 0 48 49 1 0 0 0 0 48 51 2 0 0 0 0 49 50 1 0 0 0 0 50104 1 0 0 0 0 53 54 2 0 0 0 0 53 55 1 0 0 0 0 55105 1 0 0 0 0 55106 1 0 0 0 0 55107 1 0 0 0 0 M END > 279 $$$$ 280 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 105110 0 0 1 0 0 0 0 0999 V2000 3.2080 0.1250 -4.8000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8940 -1.2770 -4.2670 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9350 -1.2510 -2.7360 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3070 -0.7500 -2.2790 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5500 0.5440 -2.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 0.5720 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -0.6690 -0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 0.0960 -6.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -1.6730 -4.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -2.5690 -2.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 1.2020 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -0.3180 -0.3140 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7770 -0.9700 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 1.7360 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 1.0140 2.0470 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6130 -0.5190 1.9510 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7260 -1.1010 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 -0.6160 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 1.6110 3.1020 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3890 0.6280 3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 3.0260 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2360 2.9660 2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 2.4630 4.5280 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6840 0.9830 4.5970 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6100 0.5670 6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 1.9920 2.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 2.6850 4.8660 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3260 2.2500 3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6580 2.1600 3.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0770 1.3890 5.0520 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3640 1.9260 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8480 1.8420 6.0890 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6210 1.0270 6.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4430 -0.1800 6.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5900 1.5190 5.2340 C 0 0 2 0 0 0 0 0 0 0 0 0 14.3040 0.8870 4.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9920 0.8390 6.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8150 0.9000 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8280 -0.5570 3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0050 1.6320 2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 1.6450 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1280 3.2000 5.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 0.2110 3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1310 2.3830 7.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -2.4930 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -0.5260 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8150 0.3410 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6400 3.7400 5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0650 1.3240 7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5410 0.6700 8.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6500 2.2860 6.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 0.8220 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -1.9830 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -0.5820 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -1.4410 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -0.1020 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 1.5860 -4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 0.9520 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.7050 -5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -2.6270 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 1.4690 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6220 1.6480 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 -0.6800 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 2.8070 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 1.5440 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -0.8260 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -0.7970 3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -2.1890 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 -1.3100 4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 2.4520 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0370 4.0640 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 3.1850 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 3.7300 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6450 1.3280 7.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6520 2.9640 6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5590 0.8050 5.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 0.7330 7.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8580 2.5740 5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0380 0.3820 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3190 0.3960 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1630 1.9310 4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7520 -0.5660 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3360 -1.0070 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0560 -1.1250 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4250 1.2870 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 2.6080 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 0.9760 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 3.3810 5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 2.5920 6.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 4.1520 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 0.3770 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 0.5610 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 -0.8530 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 2.0070 7.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6570 2.0550 8.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 3.4720 7.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 -2.8080 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -2.9510 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -2.8040 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 0.5240 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -1.1310 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 -0.6560 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2640 -0.1090 8.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0100 1.4170 9.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6910 0.2280 8.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 6 56 1 0 0 0 0 6 57 1 0 0 0 0 7 12 1 0 0 0 0 8 58 1 0 0 0 0 9 59 1 0 0 0 0 10 60 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 61 1 0 0 0 0 11 62 1 0 0 0 0 12 13 1 0 0 0 0 12 63 1 0 0 0 0 13 16 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 64 1 0 0 0 0 14 65 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 66 1 0 0 0 0 17 18 1 0 0 0 0 17 67 1 0 0 0 0 17 68 1 0 0 0 0 18 20 2 0 0 0 0 18 69 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 41 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 70 1 0 0 0 0 21 71 1 0 0 0 0 22 72 1 0 0 0 0 22 73 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 33 1 0 0 0 0 25 34 2 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 30 47 1 0 0 0 0 31 32 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 44 1 0 0 0 0 32 76 1 0 0 0 0 33 77 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 78 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 36 40 1 0 0 0 0 37 49 1 0 0 0 0 38 79 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 40 85 1 0 0 0 0 41 86 1 0 0 0 0 41 87 1 0 0 0 0 42 88 1 0 0 0 0 42 89 1 0 0 0 0 42 90 1 0 0 0 0 43 91 1 0 0 0 0 43 92 1 0 0 0 0 43 93 1 0 0 0 0 44 94 1 0 0 0 0 44 95 1 0 0 0 0 44 96 1 0 0 0 0 45 97 1 0 0 0 0 45 98 1 0 0 0 0 45 99 1 0 0 0 0 46100 1 0 0 0 0 46101 1 0 0 0 0 46102 1 0 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 50103 1 0 0 0 0 50104 1 0 0 0 0 50105 1 0 0 0 0 M END > 280 $$$$ 281 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.0730 1.4790 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -5.8660 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -6.1280 -0.8730 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4320 -4.7930 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -5.0780 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 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0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.4890 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.7250 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -3.5840 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -2.0340 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -1.1470 1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -2.3910 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -1.2180 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.4200 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 0.5230 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.0160 -3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 1.3460 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 0.6990 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 -4.9640 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 -2.0000 -3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -7.7420 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 1.4290 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 1.2880 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 2.3970 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 1.8990 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 2.2390 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 2.2220 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 31 2 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 38 1 0 0 0 0 4 7 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 11 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 30 1 0 0 0 0 11 15 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 2 0 0 0 0 22 60 1 0 0 0 0 24 61 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 32 35 2 0 0 0 0 33 34 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 M END > 281 $$$$ 282 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 92 0 0 1 0 0 0 0 0999 V2000 -0.5520 0.7600 -0.0650 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5940 -0.7560 0.1490 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3610 -1.1290 1.2860 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6790 -0.6790 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.7360 0.8020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8900 1.1850 -0.3550 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1900 -1.4180 -1.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 1.1100 -1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 1.1040 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 2.6070 -0.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.5090 2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 0.3970 12.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.1040 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -1.0230 3.6720 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4650 -1.0900 4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 1.3000 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 1.2330 5.4950 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0070 0.3120 5.0920 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0290 0.2460 6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -0.2980 7.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.6880 6.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2020 0.6230 7.8920 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6530 1.0420 8.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 1.6330 7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 0.9370 9.5780 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4250 0.1530 9.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9150 -1.3050 9.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.4210 10.3020 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3620 0.0090 10.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5370 0.2520 10.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 2.3150 10.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 0.8250 3.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 2.6150 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 3.5560 5.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.6240 8.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.9860 11.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -3.3200 11.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -3.9930 10.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -3.9780 12.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 0.8050 13.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 1.0850 14.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.8460 13.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 0.4030 12.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.4740 15.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.2650 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -1.0590 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -2.2120 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 1.2340 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 0.7190 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -2.3830 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 0.8640 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 0.6060 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 2.1830 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 0.7830 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 2.9460 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -0.4950 4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -0.0560 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -2.0220 3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -1.7460 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -1.4820 5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.9540 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 1.6920 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 1.2460 6.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -0.4110 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -0.3440 8.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -1.2990 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.3090 6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 0.0480 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 1.6810 8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 1.7350 6.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 2.6090 7.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -1.9970 9.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -1.4860 8.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -2.0450 10.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 0.0720 10.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.2690 10.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 2.8900 9.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 2.1960 11.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 2.8400 10.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.2900 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 2.7650 6.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -4.2250 12.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -4.8900 13.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -3.2960 13.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 0.9140 12.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 1.0910 11.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -0.6040 12.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 48 1 0 0 0 0 6 10 1 0 0 0 0 6 49 1 0 0 0 0 7 50 1 0 0 0 0 8 51 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 9 54 1 0 0 0 0 10 55 1 0 0 0 0 11 14 1 0 0 0 0 12 29 1 0 0 0 0 12 40 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 56 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 58 1 0 0 0 0 15 18 1 0 0 0 0 15 59 1 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 61 1 0 0 0 0 16 62 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 19 64 1 0 0 0 0 20 22 1 0 0 0 0 20 65 1 0 0 0 0 20 66 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 67 1 0 0 0 0 22 26 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 70 1 0 0 0 0 24 71 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 28 29 1 0 0 0 0 28 36 1 0 0 0 0 28 74 1 0 0 0 0 29 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 33 34 2 0 0 0 0 33 81 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 40 41 1 0 0 0 0 40 85 1 0 0 0 0 41 42 1 0 0 0 0 41 44 2 0 0 0 0 42 43 1 0 0 0 0 43 86 1 0 0 0 0 43 87 1 0 0 0 0 M END > 282 $$$$ 283 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 1.6870 3.3400 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 2.2890 -0.4570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5750 1.0910 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 2.7230 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 1.6090 1.5850 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8990 0.5640 0.9870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7480 -0.6170 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -1.3110 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 0.9450 1.8240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1430 -0.3400 2.6370 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5920 1.2590 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 1.9180 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -0.0250 3.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5390 -0.9920 2.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5040 -2.3060 3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 -2.9500 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -0.6630 3.3240 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9000 -2.0040 4.0690 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2990 -2.6250 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3330 -1.7440 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3620 -0.3460 4.0790 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9380 0.1900 4.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 2.8840 -0.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 2.2550 2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -0.0790 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 -1.7890 5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2430 0.5770 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6490 1.2980 4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 3.4480 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 -0.4160 2.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -1.3110 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 1.4450 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 4.0830 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 3.4460 -2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.0130 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 4.1450 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 3.7790 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 1.9380 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 2.2920 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 3.4880 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 0.1600 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -0.2990 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.3440 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -2.1760 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -1.6390 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 0.6970 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 1.0500 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 1.9710 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 2.8190 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 2.2000 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 0.2390 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -2.1610 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -2.9920 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -3.8710 4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 -3.2140 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 -0.8340 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2690 -3.6030 4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5790 -2.7630 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1280 -1.6700 5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3240 -2.2000 4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 2.8930 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 1.4790 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 2.8560 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -0.9870 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 0.7210 4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 0.2130 4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -2.7460 6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 -1.1140 6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 -1.3540 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2560 0.1780 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2600 1.5710 4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 0.6410 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 1.6630 4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4270 1.8520 5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7620 -0.7700 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 -0.3900 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 -1.7720 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -1.9980 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 1.6010 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 0.6310 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 2.3580 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 3.9880 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 5.1380 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 3.5830 -3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.2700 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.8980 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.3510 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 32 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 46 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 30 1 0 0 0 0 22 28 2 0 0 0 0 23 29 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 33 1 0 0 0 0 29 34 2 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 M END > 283 $$$$ ATCMD MOE2008 3D 92 95 0 0 1 0 0 0 0 0999 V2000 5.7920 -2.0910 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 -1.4130 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -0.6730 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 -1.6800 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 -1.1490 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -2.6280 -2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 -2.8340 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -3.3100 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -4.0470 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -3.0450 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 -3.5800 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -1.8040 -0.3510 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9290 -2.7760 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 0.7250 2.3740 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0470 0.7000 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -0.2980 2.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4980 -0.7000 0.4510 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0080 -0.9980 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.4930 1.4010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2970 -2.4050 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.3830 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.8350 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 0.2790 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 0.4710 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 1.3260 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 0.8960 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 0.6700 2.0040 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9120 1.6410 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -1.7950 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3020 -0.3220 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -0.4230 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -1.2900 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -2.8880 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -3.8820 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -2.9390 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 -2.5680 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.7030 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -0.8580 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.2750 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -1.3860 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6180 -1.8790 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 -1.9590 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4790 -0.4010 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -1.4890 3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -2.4440 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -1.6050 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -1.3300 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5910 -0.4880 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 0.4800 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -0.7360 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -1.1860 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 0.8570 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 1.6840 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 0.7020 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 1.2840 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -1.8310 1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 0.2400 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 2.0890 2.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 -3.3430 0.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -2.6800 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -3.0480 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -3.7730 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -3.5970 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -1.8150 1.0210 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3970 -0.9300 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -3.1380 2.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -1.4990 2.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -0.2580 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 0.6050 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 -0.3370 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -0.0480 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -1.3670 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -1.0730 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -2.3230 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -0.6200 3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -1.5770 -1.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 0.7050 3.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 1.5430 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -2.1290 1.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -3.0720 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -2.4590 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -3.8090 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -3.7230 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -4.4190 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -4.3190 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -2.1570 -3.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 3.0960 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 4.4050 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 5.1930 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 4.6440 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 4.3580 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 2.9510 3.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 64 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 12 76 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 14 58 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 37 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 56 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 77 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 29 79 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 48 1 0 0 0 0 31 52 1 0 0 0 0 32 36 1 0 0 0 0 32 40 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 36 59 2 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 56 60 1 0 0 0 0 58 87 1 0 0 0 0 60 61 1 0 0 0 0 60 66 2 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 61 64 1 0 0 0 0 64 65 1 0 0 0 0 64 67 1 0 0 0 0 67 68 1 0 0 0 0 67 72 1 0 0 0 0 68 69 1 0 0 0 0 68 70 1 0 0 0 0 68 71 1 0 0 0 0 72 73 1 0 0 0 0 72 74 1 0 0 0 0 72 75 1 0 0 0 0 76 81 1 0 0 0 0 77 78 1 0 0 0 0 79 80 1 0 0 0 0 81 82 1 0 0 0 0 81 86 2 0 0 0 0 82 83 1 0 0 0 0 82 84 1 0 0 0 0 82 85 1 0 0 0 0 87 88 1 0 0 0 0 87 92 2 0 0 0 0 88 89 1 0 0 0 0 88 90 1 0 0 0 0 88 91 1 0 0 0 0 M END > 284 $$$$ 285 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 92 95 0 0 1 0 0 0 0 0999 V2000 0.0020 2.0050 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 0.8430 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 0.2530 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.8260 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.9880 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 2.5770 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 4.0410 6.9280 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3000 1.6330 6.9120 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1930 2.4780 5.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8410 3.3210 5.5620 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2040 4.2360 4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 3.5570 3.0710 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3130 2.4100 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 1.5710 4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 0.4750 6.7180 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4970 3.4730 7.5840 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0090 1.1870 6.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 2.0670 8.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 1.0530 6.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 3.4620 6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 2.0680 6.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 5.5250 4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -0.0620 5.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 3.4010 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 1.5890 8.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 2.0170 9.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 3.0460 2.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 2.6890 5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 1.0330 6.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 1.8130 6.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 2.9920 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 2.4730 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 2.6510 -0.5950 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5430 3.3610 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 4.0830 -0.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 4.8640 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 4.3290 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 5.4840 6.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -0.5590 7.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 -1.8190 7.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 -2.9410 8.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -2.0540 6.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 4.3520 8.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 6.1810 7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 7.6850 7.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 5.6040 8.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 0.3960 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.6550 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 0.3640 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 2.4350 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 3.4840 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 3.7740 7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 2.2470 7.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 4.2900 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 2.7810 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 1.7530 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 1.1340 4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 0.7670 4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 0.0330 5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 3.9590 5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 4.0320 6.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 6.0470 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 6.0690 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 0.2450 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.2830 4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -0.9530 5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4510 4.0510 6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 4.0090 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 2.7940 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.5700 8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 2.2740 9.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 0.5870 9.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 0.9800 9.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 2.4540 10.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 2.5800 9.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8110 0.4740 7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 3.0270 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 1.4150 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 2.1820 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 4.4920 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 5.9130 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 4.7670 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 3.6350 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 5.3520 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 4.1800 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -2.9950 8.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -3.8830 7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -2.7540 9.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 27 31 1 0 0 0 0 29 76 1 0 0 0 0 31 32 1 0 0 0 0 31 34 2 0 0 0 0 32 33 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 33 35 1 0 0 0 0 33 79 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 38 44 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 86 1 0 0 0 0 41 87 1 0 0 0 0 41 88 1 0 0 0 0 43 89 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45 90 1 0 0 0 0 45 91 1 0 0 0 0 45 92 1 0 0 0 0 M END > 285 $$$$ 286 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 92 95 0 0 1 0 0 0 0 0999 V2000 1.8100 -1.7820 1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -3.8430 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.9770 0.4480 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5120 -2.5580 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -5.0660 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16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 57 1 0 0 0 0 18 24 1 0 0 0 0 18 39 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 21 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 23 72 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 33 1 0 0 0 0 25 28 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 75 1 0 0 0 0 27 76 1 0 0 0 0 28 29 2 0 0 0 0 28 77 1 0 0 0 0 29 30 1 0 0 0 0 29 78 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 38 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 33 85 1 0 0 0 0 33 86 1 0 0 0 0 33 87 1 0 0 0 0 34 88 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 89 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 38 92 1 0 0 0 0 M END > 286 $$$$ 287 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.2490 1.0290 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.4770 -0.1960 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9640 -0.7890 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.4790 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 1.2390 0.8600 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3780 -0.2660 1.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9440 -0.4940 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 0.0490 2.6050 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3760 1.5440 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 1.7760 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -1.4880 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.8720 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -1.2430 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -1.6650 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -1.2380 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -0.9260 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 1.9500 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -0.1680 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -1.6610 4.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 0.3380 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 -0.3020 3.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -1.8640 5.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 0.5500 4.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.2490 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 1.5640 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.0200 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.9090 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 2.5410 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 0.0270 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -1.5620 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -0.4790 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 2.0750 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 1.9190 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 1.2530 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 2.8440 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -1.8530 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.7000 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -1.6060 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.0050 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -2.6910 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -1.8860 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 1.5560 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.7800 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 3.0190 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -2.0210 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -2.2080 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 1.4160 3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 0.1070 5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 -0.0290 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -2.7890 5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 0.2810 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 19 22 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 M END > 287 $$$$ 288 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.6250 1.6270 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 0.2110 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -0.4850 -0.8920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7580 2.1620 -0.1870 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4410 1.1020 -1.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5150 -0.5780 -2.1070 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6590 0.8690 -4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 2.2750 -4.7800 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6170 2.9900 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 2.8150 -2.8060 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5740 0.8530 -2.6760 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9310 1.3440 -2.5150 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0640 3.4820 -2.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.1320 -4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 2.9840 -4.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -1.6080 -2.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -1.5160 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 0.6040 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3880 -1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 2.2250 1.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 3.4210 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 4.3780 0.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 3.5720 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 2.3920 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 1.6550 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 0.2730 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 3.9100 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 2.1450 -0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.5960 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 0.2420 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 1.5390 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 3.1450 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 0.0830 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.8630 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 2.1830 -5.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 2.6660 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 4.0670 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 3.2740 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 4.4340 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -1.1460 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 0.0530 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 3.8840 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -2.4760 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 1.0210 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -0.4560 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 0.7240 -4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 1.3530 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 2.9180 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 4.6070 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 3.3000 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 0.3460 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -0.3080 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 4.2720 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 4.2960 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 4.2500 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.0160 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -1.4780 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.9070 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 0.8180 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -0.7760 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 0.7060 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 2 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 32 1 0 0 0 0 5 12 1 0 0 0 0 5 19 1 0 0 0 0 5 33 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 18 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 28 2 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 M END > 288 $$$$ 289 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0420 1.3320 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0440 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.7040 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.0150 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 1.3960 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.0510 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -1.1060 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -1.7350 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -1.8500 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -2.2030 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1040 -2.8480 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -1.0130 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -2.2040 0.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0810 3.5510 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -2.6090 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -4.0410 1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -4.5600 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -6.0390 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -3.8430 3.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -2.8470 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 1.8460 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.6030 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 1.9580 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -2.7920 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 -1.8220 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -1.0200 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -2.1200 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 -3.1670 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 -2.1300 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1520 -3.7140 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -2.5410 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 3.8150 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 3.9380 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 3.9850 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -2.0810 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -2.3500 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -6.5180 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -6.2000 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -6.4690 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -2.5580 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -3.9320 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -2.5090 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END > 289 $$$$ 290 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 -0.6340 2.0150 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 1.1880 -2.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 2.7350 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -0.4760 -6.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -1.3100 -4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -1.6590 -4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -1.1510 -6.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 0.6150 -0.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1270 0.3420 -1.4950 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4070 -1.1090 -1.8370 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0610 -1.9850 -0.6130 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4000 -3.3280 -1.1430 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4350 -3.1980 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.6640 -2.9370 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9180 -1.6980 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.2430 0.6400 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0070 -0.1730 4.1230 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2280 -2.5950 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -0.4380 2.6210 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5940 0.1850 2.0940 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6480 1.6830 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 2.3680 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 1.6730 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 0.1930 1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -1.2890 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 2.2630 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -0.0100 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -0.4430 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.9010 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.3130 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.4440 -0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -0.5480 -5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 -0.2820 5.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.2370 4.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -0.1350 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.5270 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 2.8820 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 2.3960 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 3.3290 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -2.8710 5.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 2.4830 0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 4.3520 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 1.2530 4.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 0.9990 6.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 1.7400 5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 3.2100 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -1.5130 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.0330 -7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -2.2480 -4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 0.4160 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 0.5850 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.2760 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -3.6990 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -3.6060 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -1.3040 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -3.6370 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -2.2920 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 2.2300 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 3.4460 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -0.6600 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -2.3330 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -1.0030 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -0.9680 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -0.0010 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 0.7930 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -0.0420 3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -0.2160 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -1.5230 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.1180 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -0.0110 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -1.4000 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -0.1070 -5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 3.9550 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 3.9600 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 2.7470 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -3.9490 4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -2.6560 6.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3590 -2.4860 4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 4.5770 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 4.9320 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 4.6080 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 3.7340 5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 3.6080 5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 3.3510 6.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 37 1 0 0 0 0 2 9 1 0 0 0 0 2 38 1 0 0 0 0 3 38 2 0 0 0 0 4 7 1 0 0 0 0 4 32 2 0 0 0 0 4 48 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 20 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 17 36 1 0 0 0 0 17 43 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 26 2 0 0 0 0 24 27 1 0 0 0 0 24 28 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 29 33 2 0 0 0 0 29 34 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 32 72 1 0 0 0 0 34 40 1 0 0 0 0 37 41 2 0 0 0 0 37 42 1 0 0 0 0 38 39 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 40 78 1 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 43 45 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 46 82 1 0 0 0 0 46 83 1 0 0 0 0 46 84 1 0 0 0 0 M END > 290 $$$$ ATCMD MOE2008 3D 60 64 0 0 1 0 0 0 0 0999 V2000 -0.4240 3.1430 4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 4.1740 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 2.5360 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 2.7240 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 1.3020 4.2490 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3990 3.0830 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 3.8190 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 3.4250 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.6870 1.9810 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2380 1.1110 2.6780 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6140 -0.3140 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -1.0620 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -0.5380 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -0.5140 0.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5360 -1.0410 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.7400 0.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5310 0.8100 -0.1000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0810 1.6390 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 1.5470 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 1.2760 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 3.4510 -1.3170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5590 4.3760 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 3.2460 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 3.1960 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 4.0860 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 2.8090 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 3.4560 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 1.1680 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 1.8380 4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 0.1480 4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 1.7410 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.2550 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 0.3240 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 0.3850 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -0.7670 4.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 0.7720 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 0.6880 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -0.2480 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 1.1760 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 3.9200 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 3.5280 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 4.7440 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 4.3940 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 2.1760 -1.8690 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0210 2.2460 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 0.7600 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.4590 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 0.1090 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.8500 -0.3560 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0010 1.0360 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 1.6270 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 1.4590 6.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 2.4210 6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -1.3580 0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -2.2810 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -3.0160 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -3.5120 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -3.7780 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -2.3190 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -2.4910 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 10 1 0 0 0 0 5 28 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 54 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 44 1 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 52 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 40 49 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 49 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 60 2 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 56 59 1 0 0 0 0 M END > 291 $$$$ 292 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 92 0 0 1 0 0 0 0 0999 V2000 -0.3320 1.4600 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.0800 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.6560 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.0290 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 1.3380 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 2.0860 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 9.5200 -3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 9.1480 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 7.9560 -4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 7.1300 -4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 7.4990 -3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 8.7030 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 6.0630 -3.3390 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5440 6.8550 -3.2670 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5510 7.5460 -1.8640 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1240 4.9940 -2.2600 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4940 5.5230 -0.8600 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8040 6.3020 -0.9870 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4570 6.6670 0.3260 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6120 5.4420 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 4.7390 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 4.3000 0.0400 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4830 3.5850 0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 6.3400 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 4.5360 -2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 6.9780 -3.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 5.4610 -1.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 5.8940 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 6.6390 -3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6530 4.7140 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 8.5260 -1.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3200 9.7900 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 10.0680 -2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 10.8620 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 7.7920 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 2.2540 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 1.7060 0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 6.6200 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 5.5730 -4.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 3.4970 -3.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 2.9790 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 2.9860 -3.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 1.9030 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 1.4240 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 2.0090 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 3.0750 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 3.5680 -2.2120 C 0 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7.2480 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 6.6060 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 5.7510 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 7.0360 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 5.9510 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 7.4600 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 4.1540 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 4.0620 -3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 5.0840 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 11.3170 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 11.6240 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3570 10.4200 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 8.6430 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 8.0940 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 7.4470 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 1.4460 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 0.5920 -4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 1.6300 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 3.5260 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 4.4000 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 49 1 0 0 0 0 4 5 2 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 51 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 53 1 0 0 0 0 8 9 2 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 10 11 2 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 26 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 59 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 61 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 62 1 0 0 0 0 20 21 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 21 22 1 0 0 0 0 21 65 1 0 0 0 0 21 66 1 0 0 0 0 22 23 1 0 0 0 0 22 67 1 0 0 0 0 23 36 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 24 70 1 0 0 0 0 25 40 1 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 37 2 0 0 0 0 38 39 2 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 43 1 0 0 0 0 41 47 2 0 0 0 0 43 44 2 0 0 0 0 43 83 1 0 0 0 0 44 45 1 0 0 0 0 44 84 1 0 0 0 0 45 46 2 0 0 0 0 45 85 1 0 0 0 0 46 47 1 0 0 0 0 46 86 1 0 0 0 0 47 87 1 0 0 0 0 M END > 292 $$$$ ATCMD MOE2008 3D 60 63 0 0 1 0 0 0 0 0999 V2000 -3.5220 -0.6880 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -2.0130 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.7780 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -2.3610 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -1.5070 0.4580 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5680 -0.4200 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 0.6210 0.2860 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5540 0.6720 1.3370 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2140 0.7500 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 2.0190 0.2080 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2610 2.1370 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 2.1680 1.6560 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7570 2.4330 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -1.7400 0.8940 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0450 -2.1120 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -1.0830 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -2.6150 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -3.9670 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.5780 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -5.6690 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -4.2980 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.2980 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -4.6570 -0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 0.7630 2.0850 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3710 -0.1670 0.8230 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7380 -0.1370 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -0.8540 0.7770 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7190 -1.9360 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -0.3670 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -1.1320 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -0.2160 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.9380 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 1.6780 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 1.3170 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4780 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 0.4740 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 0.9940 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -0.6560 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -1.2230 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 0.2320 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.5540 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.2220 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 1.0350 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 3.2870 1.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 3.1910 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 3.0490 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 3.8830 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 1.8850 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 2.0830 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 2.7860 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 1.7430 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -0.6840 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -0.0760 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 0.1310 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 0.8100 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -0.8990 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.8110 -1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -1.2010 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -1.6160 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 0.0380 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 52 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 46 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 44 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 35 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 38 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 57 60 1 0 0 0 0 M END > 293 $$$$ 294 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 91 94 0 0 1 0 0 0 0 0999 V2000 1.2230 1.4100 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 0.1150 -0.5940 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6070 -1.0850 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 1.6410 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 0.5010 1.2600 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0450 -0.8150 0.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6870 -1.9690 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 -1.7680 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 0.7130 1.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5800 -0.4580 1.9590 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6680 2.3130 1.9020 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1560 2.0320 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 1.1520 2.5230 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0600 -0.1620 1.7780 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0400 -1.1280 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 -0.3080 2.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9380 1.1830 2.4340 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4260 -0.1070 -0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.4870 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -2.2600 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 0.5720 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 -0.6240 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -0.0700 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5210 1.8760 3.6680 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9880 1.2000 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 3.2520 3.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1620 -0.6010 3.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 1.9510 6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 1.2850 7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3340 1.9910 8.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 3.4880 8.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 1.3070 9.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 1.0830 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0470 1.7700 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 0.4100 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 0.2200 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 1.0260 -2.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 3.5220 2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2580 1.6880 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 2.2450 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 1.3940 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 0.1960 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.6540 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 2.5880 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -0.7380 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -2.0130 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -2.9210 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 -2.6010 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -1.7590 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 0.8240 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9310 2.4390 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 2.8430 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 2.0120 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 -1.3230 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 -2.0480 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9160 -0.5380 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -1.7230 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.3630 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.6630 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -1.9970 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -3.1490 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.4630 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 0.6600 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.3340 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 1.4400 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -1.4130 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 0.3130 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -0.8890 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 0.7290 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5080 0.1420 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 -1.0170 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 1.2160 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3360 0.1670 4.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 3.4100 3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4260 -1.5280 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5860 1.9350 6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 2.9830 6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1180 0.2260 7.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 3.7330 7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 3.9430 9.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 3.8690 7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 1.2540 10.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 1.8740 9.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 0.3000 9.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4350 2.3380 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 2.1710 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3370 0.7240 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 1.0450 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 0.2000 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -0.7200 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 4.3060 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 42 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 50 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 56 1 0 0 0 0 17 24 1 0 0 0 0 17 39 1 0 0 0 0 18 35 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 25 28 1 0 0 0 0 25 72 1 0 0 0 0 25 73 1 0 0 0 0 26 74 1 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 29 30 2 0 0 0 0 29 78 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 34 87 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 88 1 0 0 0 0 36 89 1 0 0 0 0 36 90 1 0 0 0 0 38 91 1 0 0 0 0 M END > 294 $$$$ 295 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 91 94 0 0 1 0 0 0 0 0999 V2000 2.1240 3.0420 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.8330 -0.8110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5220 0.6090 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 2.7150 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 1.5740 1.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9560 0.3640 0.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1100 -0.8280 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -1.2270 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 1.2090 1.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4410 -0.0720 2.0200 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5040 2.0430 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.3790 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7470 0.7870 2.4580 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9200 -0.3880 1.8760 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4600 -1.5430 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 -1.3020 2.6470 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1720 0.2240 2.4390 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0130 2.1490 -1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 0.7390 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.6010 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 2.0820 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 0.0910 3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 -0.6580 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9840 0.8220 3.5910 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3770 0.1920 3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3200 0.5580 4.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6240 -1.7030 3.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1760 0.7800 4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7190 -0.0060 5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5180 0.5830 6.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8750 0.1940 8.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9490 0.0460 6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5380 2.0070 6.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4840 0.9690 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1110 2.3340 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 2.6840 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 3.0370 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 2.8820 -3.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 0.4340 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 3.8700 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 3.3650 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.5920 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 2.3960 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 3.5950 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 0.0820 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -0.5900 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -1.6820 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -2.0960 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -1.4860 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 1.0400 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 1.9230 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 2.8720 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 3.2570 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 2.6050 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -1.4720 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1960 -2.5020 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4180 -1.8530 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 0.8110 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.1360 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 1.6360 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.7070 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -1.5080 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 2.5930 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 1.2410 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 2.7770 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -0.7700 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 0.9990 3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 0.1600 3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 0.2220 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3690 -0.8800 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -1.5080 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2860 -0.8860 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 0.3930 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3180 -0.3750 5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 -2.6410 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3020 1.8510 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5930 -1.0760 5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8590 -0.8920 8.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4520 0.6200 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8550 0.5770 8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4070 0.3230 5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5270 0.4720 7.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9330 -1.0400 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0360 2.4540 7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 2.7990 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7940 2.7420 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 2.5390 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 4.0640 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 2.9410 -3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 2.3630 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 42 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 50 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 57 1 0 0 0 0 17 24 1 0 0 0 0 17 39 1 0 0 0 0 18 36 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 21 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 23 72 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 35 1 0 0 0 0 25 28 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 75 1 0 0 0 0 27 76 1 0 0 0 0 28 29 2 0 0 0 0 28 77 1 0 0 0 0 29 30 1 0 0 0 0 29 78 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 33 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 35 88 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 89 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 M END > 295 $$$$ 296 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 0.0440 1.1250 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.3760 -0.4280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2040 -0.6860 -1.6110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3740 1.8500 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.6460 -1.3500 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4690 0.1440 -1.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4120 -0.1090 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 0.4240 -2.3380 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6180 2.2740 -1.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7230 1.9100 -2.0450 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6260 2.7130 -3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 4.1370 -2.8530 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7970 4.6260 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 3.7690 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -2.1780 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -0.2690 -1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 2.4160 -1.4270 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1990 3.8670 -1.9200 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7260 5.0090 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 6.2220 -1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.5440 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.0510 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 2.3140 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -2.9870 -1.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 2.8170 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -1.4590 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -1.2590 1.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -2.1660 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.5080 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.3020 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.7540 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.9140 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 1.4480 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -0.2020 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -1.1750 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 0.3980 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4870 0.2600 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 1.8240 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 2.3620 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.6850 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 4.8120 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 5.6620 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 4.6210 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 4.0270 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 4.0130 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.4600 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -2.3290 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -1.2240 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 2.1180 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 5.1220 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7440 4.7830 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 6.9910 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.4350 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6430 -3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -1.3230 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 3.3950 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 2.0610 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 1.9640 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -3.9350 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -3.2400 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -1.9560 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -1.8140 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 24 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 26 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 M END > 296 $$$$ 297 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 0.0440 1.1240 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -0.3770 -0.4280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2060 -0.6890 -1.6100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3750 1.8480 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.6420 -1.3510 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4700 0.1410 -1.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4140 -0.1120 -2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 0.4210 -2.3320 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6180 2.2740 -1.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7240 1.9080 -2.0430 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6270 2.7050 -3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 4.1320 -2.8600 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7920 4.6230 -2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 3.7700 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -2.1800 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -0.2690 -1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 2.4180 -1.4270 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1940 3.8690 -1.9230 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7140 5.0140 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 6.2260 -1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -0.5480 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -1.0420 -0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 2.3100 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -3.0010 -1.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -4.3280 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -5.2440 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -4.7880 -1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 2.8200 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.5060 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.3010 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.7550 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.9130 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 1.4470 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -0.2050 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -1.1780 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 0.3960 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 0.2560 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 1.8290 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 2.3540 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.6740 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 4.8050 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 5.6600 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 4.6170 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 4.0250 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 4.0220 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -2.4630 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -2.3300 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -1.2240 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 2.1230 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 5.1260 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7320 4.7930 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 6.9970 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.4310 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.6470 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -1.3260 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -0.9150 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 3.3910 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 2.0550 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 1.9600 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -4.6530 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -5.9380 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -5.8050 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 24 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 M END > 297 $$$$ 298 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 0.0970 1.1900 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.3080 -0.4590 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2650 -0.5990 -1.6420 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4270 1.9100 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.7280 -1.3340 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5290 0.2300 -1.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4860 -0.0100 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 0.5180 -2.3180 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6780 2.3440 -1.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7850 1.9990 -2.0180 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6740 2.8100 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 4.1880 -2.7460 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9260 4.7080 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 3.8310 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -2.0930 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -0.1820 -1.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 2.5390 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 3.7790 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3970 4.6630 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 3.9470 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -0.4330 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.9800 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 2.4190 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -2.9000 -1.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -1.4060 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -1.2250 1.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.1110 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 1.5870 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.3520 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.7020 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 2.9720 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 1.4920 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.1320 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.0740 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.5050 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 0.3600 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 1.8640 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 2.4540 -4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 2.8440 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 4.8850 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 5.7280 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 4.7410 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 4.1040 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 4.0370 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -2.3610 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -2.2610 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -1.1360 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 1.9840 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9570 4.9600 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 5.5510 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0230 4.4560 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.5480 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.5200 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.2080 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 3.4980 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 2.1780 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 2.0770 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -3.8490 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -3.1840 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -1.9150 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -1.7430 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 M END > 298 $$$$ 299 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 0.0970 1.1890 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.3090 -0.4590 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2660 -0.6020 -1.6410 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4270 1.9090 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 1.7250 -1.3330 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5300 0.2260 -1.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4870 -0.0140 -2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 0.5140 -2.3180 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6790 2.3410 -1.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7860 1.9950 -2.0170 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6750 2.8060 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 4.1840 -2.7450 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9270 4.7050 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.8280 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -2.0960 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -0.1850 -1.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 2.5350 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 3.7750 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3970 4.6590 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 3.9420 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.4350 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.9710 -0.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 2.4160 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -2.9150 -1.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -4.2440 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -5.1570 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -4.7070 -1.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 1.5860 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.3520 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -0.7020 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 2.9710 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 1.4920 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.1340 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -1.0780 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.5040 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 0.3570 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 1.8590 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 2.4500 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 2.8400 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 4.8810 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 5.7240 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 4.7390 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 4.1000 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 4.0330 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -2.3650 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -2.2630 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 -1.1400 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7170 1.9780 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 4.9570 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 5.5460 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0220 4.4510 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.5460 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.5230 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -1.2100 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -0.8570 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 3.4950 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 2.1740 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 2.0750 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -5.4360 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -6.0540 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -4.6420 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 M END > 299 $$$$ 300 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 70 0 0 1 0 0 0 0 0999 V2000 0.2990 0.2600 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -1.2050 -0.3420 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6320 -1.6810 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 1.0680 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 0.6020 1.1000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4420 -0.8800 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -1.4760 2.3360 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8110 -1.0000 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 1.0460 0.8390 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8510 0.5310 1.9510 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3890 3.0410 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 2.5830 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 2.5040 1.6470 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2870 0.9750 1.7550 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8610 0.4630 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 1.3890 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 2.6830 0.9530 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8900 2.8800 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 4.1450 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 4.3000 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8560 3.1890 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6370 1.9980 3.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 1.8420 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7400 3.3080 4.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 3.8240 -0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -2.0010 -0.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.0250 3.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 1.2860 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 1.0420 3.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 0.4880 2.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 3.1860 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 0.6650 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -1.8550 4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -1.4550 6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -2.9240 4.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.6390 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 0.3380 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -1.2900 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.7350 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 0.9410 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 2.1230 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -2.5640 2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -1.3600 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -1.3970 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 2.9610 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 2.9510 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 -0.5730 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 0.5630 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9860 0.9140 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 1.6120 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 3.5360 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4650 4.9820 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 5.2610 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 0.8720 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.9410 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.1260 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 0.8650 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 2.3560 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 0.7000 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 0.6350 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 3.0070 3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 2.7780 3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 4.2580 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -1.2870 6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -2.2500 6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -0.5390 6.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 38 1 0 0 0 0 3 6 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 32 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 2 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 23 54 1 0 0 0 0 26 55 1 0 0 0 0 27 33 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 300 $$$$ 301 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 89 0 0 1 0 0 0 0 0999 V2000 1.2920 3.1950 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 1.9130 1.6880 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8020 1.1170 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 2.8630 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 2.1920 2.9820 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2970 0.9200 3.0930 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6990 0.1180 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -0.3480 4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 1.7730 2.9330 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0750 0.8720 4.0650 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8060 2.8210 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 2.8970 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4880 1.6610 3.7970 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5250 0.4690 3.8200 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9850 -0.6590 4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -0.1890 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0290 2.0630 5.1570 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5110 0.8660 5.9800 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7470 0.2220 5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 1.2340 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3390 2.3920 4.2850 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2030 3.0440 5.0720 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1490 1.7480 4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.2760 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 2.2370 1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 2.2990 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 2.6300 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 2.0910 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 3.2120 4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 1.6050 5.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8430 1.3200 7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 1.8020 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5240 1.8170 2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 1.2780 2.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8380 4.4170 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 -0.1440 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 0.2900 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 1.1890 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 2.5710 5.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 3.6730 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 3.8980 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 1.2900 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 2.1700 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 3.7750 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.7040 5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -0.7720 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -0.9340 5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -0.9630 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 3.6490 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 3.8160 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -1.3950 4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8310 -1.1630 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5850 0.1820 6.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 -1.0520 6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1020 -0.5780 6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4830 -0.2220 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2260 1.6180 6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 0.7540 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1370 3.1080 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 3.2180 6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 1.7740 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 1.1590 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 2.7640 4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.7510 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.8970 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.1590 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 3.7090 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 2.1450 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 2.2740 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 3.7380 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 2.7020 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 3.9280 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 0.9800 6.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 2.5430 5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 1.8110 5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1850 0.4650 7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6270 2.0760 7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 1.7410 7.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 4.7850 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6700 5.1030 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 4.3490 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 0.5970 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -0.4430 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -1.0160 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 42 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 38 1 0 0 0 0 10 14 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 59 1 0 0 0 0 22 35 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 M END > 301 $$$$ 302 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 78 83 0 0 1 0 0 0 0 0999 V2000 -1.0320 3.1610 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 1.9030 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 0.9240 -0.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3920 3.4670 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 2.4710 -1.2160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7910 0.3900 -3.4050 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7430 2.7720 -2.6820 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6450 1.6520 -3.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0180 4.4690 -4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 4.1400 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.3560 -4.4240 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1510 2.0700 -4.5970 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1570 1.1150 -5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 2.0250 -6.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 3.4770 -5.7590 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1030 4.1180 -5.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8130 4.2430 -6.9060 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9310 5.5080 -4.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 3.3030 -4.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 2.9130 -7.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 2.9160 -8.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 3.9030 -8.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 4.8650 -7.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 4.9780 -6.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 1.2090 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 4.4860 -0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 2.6260 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.0010 -2.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8800 1.0560 -1.0330 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8640 0.0200 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -0.7010 -3.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 1.4620 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 2.2590 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 2.8090 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 3.1800 -3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 4.0640 -6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 2.1320 -9.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 3.8210 -10.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0780 5.8700 -8.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -1.6240 -4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.7850 -5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -1.5230 -4.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 4.7950 -7.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 3.9100 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 1.6020 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.0910 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 0.5780 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 4.5020 -4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 5.4260 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 4.9040 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 4.1600 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 0.7290 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 0.2990 -5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 1.7580 -6.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 1.9240 -7.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 5.4200 -3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 5.9660 -4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 6.1300 -5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 2.4060 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 6.0300 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 4.5420 -5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 1.1470 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 2.2960 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 2.0190 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 3.6720 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.7890 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 3.0110 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 2.3240 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 4.0780 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3390 2.9740 -10.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5530 4.7410 -10.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 3.6900 -9.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5820 5.6420 -9.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6490 6.8700 -8.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7960 5.8240 -7.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -2.7060 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -3.7190 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -2.7690 -6.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 3 25 1 0 0 0 0 3 29 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 26 2 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 6 31 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 34 1 0 0 0 0 8 12 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 24 1 0 0 0 0 17 43 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 66 1 0 0 0 0 29 30 1 0 0 0 0 31 40 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 38 70 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 76 1 0 0 0 0 41 77 1 0 0 0 0 41 78 1 0 0 0 0 M END > 302 $$$$ 303 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 116121 0 0 1 0 0 0 0 0999 V2000 1.2780 2.9010 -6.2670 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4600 1.5240 -6.9100 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9280 1.3460 -7.3110 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8100 1.5310 -6.0720 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5370 2.9080 -5.4620 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1490 3.0190 -5.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 3.0660 -4.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 3.0630 -5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 4.3930 -5.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 0.0350 -7.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.4390 -6.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.4250 -8.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 4.3650 -2.3230 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3070 4.3970 -3.7440 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7250 4.9640 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 5.7760 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 6.2710 -1.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8390 6.2700 -3.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2620 6.8230 -2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1960 8.3100 -2.5820 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2410 7.7180 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 8.4420 -1.1970 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1040 9.7050 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 8.2950 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 3.9160 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 5.2390 -5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 5.4340 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 8.9760 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 10.0220 0.3980 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5260 9.8800 -0.6860 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8870 10.3200 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8610 11.7670 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 11.4370 0.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8090 11.9120 1.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4210 13.3690 1.7930 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0780 13.1890 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 11.8120 2.0960 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1940 11.9320 1.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 13.9710 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7970 14.1020 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 15.3540 3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 8.8330 -2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 10.7990 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 11.2450 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 7.8940 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 3.8890 -2.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 3.2910 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 3.2500 -0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 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-1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 2.8010 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 3.1560 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 10.4040 6.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 11.2120 7.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 12.1620 6.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 58 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 59 1 0 0 0 0 8 60 1 0 0 0 0 9 61 1 0 0 0 0 10 62 1 0 0 0 0 11 63 1 0 0 0 0 12 64 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 13 65 1 0 0 0 0 14 15 1 0 0 0 0 14 66 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 67 1 0 0 0 0 16 68 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 69 1 0 0 0 0 19 20 1 0 0 0 0 19 70 1 0 0 0 0 19 71 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 20 72 1 0 0 0 0 21 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0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 49111 1 0 0 0 0 49112 1 0 0 0 0 49113 1 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 51 53 1 0 0 0 0 53114 1 0 0 0 0 53115 1 0 0 0 0 53116 1 0 0 0 0 M END > 303 $$$$ 304 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 98104 0 0 1 0 0 0 0 0999 V2000 0.4100 1.6910 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 0.6860 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 0.0330 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 0.3720 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 1.3660 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.0280 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 9.0990 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 9.1640 -1.9050 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0820 8.8510 -2.2200 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3970 7.7020 0.0880 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0110 7.2310 -0.3530 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6940 7.4300 -1.8400 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1760 7.3610 -1.9060 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6750 7.4560 -0.4540 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3650 6.0340 -0.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8660 5.7460 0.0150 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5360 5.1530 -0.4300 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4770 3.8700 0.4030 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8810 4.3750 1.7800 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8560 5.5330 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 10.4880 -2.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 7.7060 1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 8.0220 0.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5100 8.2890 -2.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 9.8200 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 6.0000 1.4370 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6440 5.0210 2.3820 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9570 7.3080 2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 3.2860 0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 9.4390 -0.0230 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.1350 10.3060 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 6.6740 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 5.1840 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 4.9190 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 3.3470 2.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 4.0190 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0 0 0 0 1.2350 2.8050 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 9.8530 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 9.2800 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 8.4260 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 6.9910 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 6.3500 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 8.0990 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 3.1470 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 6.4230 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 5.2530 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 7.8650 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 9.9770 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 10.8110 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 5.7000 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 5.5740 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 7.3210 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 10.0520 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 10.1640 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 3.6520 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3960 12.0780 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5970 12.2240 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0 0 0 -6.7050 7.3760 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 49 1 0 0 0 0 2 3 2 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 54 1 0 0 0 0 4 5 2 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 56 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 58 1 0 0 0 0 7 59 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 60 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 61 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 62 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 63 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 64 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 19 35 1 0 0 0 0 20 65 1 0 0 0 0 20 66 1 0 0 0 0 21 37 1 0 0 0 0 22 52 1 0 0 0 0 23 30 1 0 0 0 0 23 67 1 0 0 0 0 24 44 1 0 0 0 0 25 30 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 70 1 0 0 0 0 27 36 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 40 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 35 75 1 0 0 0 0 36 51 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 41 42 1 0 0 0 0 41 82 1 0 0 0 0 41 83 1 0 0 0 0 42 43 1 0 0 0 0 43 84 1 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 44 87 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 2 0 0 0 0 47 90 1 0 0 0 0 47 91 1 0 0 0 0 47 92 1 0 0 0 0 49 50 2 0 0 0 0 51 93 1 0 0 0 0 51 94 1 0 0 0 0 51 95 1 0 0 0 0 52 96 1 0 0 0 0 52 97 1 0 0 0 0 52 98 1 0 0 0 0 M END > 304 $$$$ 305 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.6590 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6220 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 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3 1 0 0 0 0 2 4 2 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 25 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 10 22 1 0 0 0 0 10 55 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 59 1 0 0 0 0 17 60 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 18 63 1 0 0 0 0 19 64 1 0 0 0 0 20 65 1 0 0 0 0 21 66 1 0 0 0 0 22 24 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 23 38 1 0 0 0 0 24 69 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 29 2 0 0 0 0 27 70 1 0 0 0 0 29 30 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 72 1 0 0 0 0 32 33 1 0 0 0 0 32 37 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 39 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 39 40 1 0 0 0 0 39 79 1 0 0 0 0 39 80 1 0 0 0 0 40 41 1 0 0 0 0 40 45 2 0 0 0 0 41 42 2 0 0 0 0 41 81 1 0 0 0 0 42 43 1 0 0 0 0 42 47 1 0 0 0 0 43 44 2 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 44 82 1 0 0 0 0 45 83 1 0 0 0 0 46 84 1 0 0 0 0 47 85 1 0 0 0 0 M END > 305 $$$$ 306 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -0.5460 -5.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 0.1900 -6.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2640 1.3000 -6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 1.6820 -5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 0.9490 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -0.1700 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 1.3540 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 2.4360 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 2.8260 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 3.9060 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 2.1880 -0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 -1.6360 -5.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6940 -0.1810 -7.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 7.5700 -1.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7460 8.3970 -0.5940 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3760 7.7230 -0.7050 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0200 7.5940 -2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 6.7910 -2.8460 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3150 7.4270 -2.8210 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6770 9.7130 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 8.2300 -1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 6.7000 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 6.5960 -3.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 6.4280 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 5.5780 2.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 4.2420 -0.1240 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1720 5.7560 -0.0520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4640 6.0950 1.2630 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1520 5.3100 1.3440 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4280 3.9120 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 3.5290 0.0110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1850 7.4960 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 4.7030 4.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 3.4330 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 2.8520 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 3.5450 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 4.8240 3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 5.3990 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 5.3320 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 4.9810 2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4570 2.9750 4.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2160 5.5070 3.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.5150 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -1.8440 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -0.5240 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 1.8670 -7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 2.5470 -5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -0.7390 -3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 0.7880 -1.7370 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-0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 7.7820 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 2.8920 5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 1.8600 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 6.3920 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 6.4150 4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 4.9560 4.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 5.3580 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 3.8980 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 3.1560 5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6100 6.0500 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 48 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 8 9 2 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 53 1 0 0 0 0 11 12 2 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 31 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 25 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 61 1 0 0 0 0 23 27 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 25 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 28 32 1 0 0 0 0 29 34 1 0 0 0 0 29 45 1 0 0 0 0 30 36 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 31 71 1 0 0 0 0 32 33 1 0 0 0 0 32 72 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 33 73 1 0 0 0 0 34 35 1 0 0 0 0 34 74 1 0 0 0 0 35 36 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 38 44 1 0 0 0 0 39 40 2 0 0 0 0 39 77 1 0 0 0 0 40 41 1 0 0 0 0 40 78 1 0 0 0 0 41 42 2 0 0 0 0 41 46 1 0 0 0 0 42 43 1 0 0 0 0 42 47 1 0 0 0 0 43 79 1 0 0 0 0 44 45 1 0 0 0 0 44 80 1 0 0 0 0 44 81 1 0 0 0 0 45 82 1 0 0 0 0 45 83 1 0 0 0 0 46 84 1 0 0 0 0 47 85 1 0 0 0 0 M END > 306 $$$$ 307 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 93 98 0 0 1 0 0 0 0 0999 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5.0700 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 6.5090 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 6.9010 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 5.8550 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 3.3040 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 1.5520 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 2.7890 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 4.3370 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 2.4030 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 1.2000 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 2.5210 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 -0.1180 3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 1.1700 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -0.1480 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 5.4530 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 6.3090 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 9.3850 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 10.4820 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 10.5360 4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.4010 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -0.0060 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -1.2260 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -0.1440 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -1.7890 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -3.1440 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -3.8810 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -4.0250 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -2.6700 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 8.6280 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 9.8600 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 9.1120 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 53 1 0 0 0 0 4 54 1 0 0 0 0 5 55 1 0 0 0 0 5 56 1 0 0 0 0 6 41 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 59 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 60 1 0 0 0 0 12 61 1 0 0 0 0 13 20 1 0 0 0 0 13 28 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 62 1 0 0 0 0 16 17 1 0 0 0 0 16 63 1 0 0 0 0 17 18 2 0 0 0 0 17 64 1 0 0 0 0 18 19 1 0 0 0 0 18 65 1 0 0 0 0 19 66 1 0 0 0 0 20 29 1 0 0 0 0 20 67 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 25 2 0 0 0 0 23 69 1 0 0 0 0 24 26 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 29 1 0 0 0 0 27 34 1 0 0 0 0 27 35 1 0 0 0 0 29 39 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 32 33 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 35 36 1 0 0 0 0 35 78 1 0 0 0 0 36 47 1 0 0 0 0 37 38 1 0 0 0 0 38 79 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 39 40 2 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 42 82 1 0 0 0 0 44 83 1 0 0 0 0 44 84 1 0 0 0 0 44 85 1 0 0 0 0 45 46 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 46 88 1 0 0 0 0 46 89 1 0 0 0 0 46 90 1 0 0 0 0 47 48 1 0 0 0 0 47 49 2 0 0 0 0 48 91 1 0 0 0 0 48 92 1 0 0 0 0 48 93 1 0 0 0 0 M END > 307 $$$$ 308 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0300 1.3700 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.0280 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.7400 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -0.5650 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 5.7970 0.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8120 5.7150 -0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 4.7620 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 3.7000 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 4.4140 0.4420 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1310 3.4170 -0.7200 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2560 2.0430 -0.0270 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7110 2.3160 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 3.8460 1.5520 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6620 6.2650 -1.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 3.4460 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 4.4520 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 4.2690 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 4.2790 2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 10.7410 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 10.4080 1.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 10.3170 -1.9480 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4600 9.4070 -3.1290 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1730 7.9520 -2.7420 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9670 7.6020 -1.4810 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6140 8.5050 -0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 9.8750 -0.7180 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4370 11.6690 -2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 9.7650 -4.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 7.0880 -3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -0.9020 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -1.7020 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -0.1710 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 6.4880 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 4.8850 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 2.9840 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 1.4310 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.9480 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 1.8320 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 3.8780 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 5.3570 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 3.8730 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 3.9060 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 10.5600 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 11.7930 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 10.9190 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 10.2420 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 9.5180 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 7.8300 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 7.6860 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 9.9880 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 12.0130 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 9.2280 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 6.1500 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 14 24 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 27 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END > 308 $$$$ 309 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0700 1.5010 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.1370 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.5870 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 2.2040 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 1.5030 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 0.0920 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -0.6330 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 0.1100 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 1.4520 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 2.2050 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -1.8280 0.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 3.3910 0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 3.5590 0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.9420 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 -0.6430 -0.6500 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0620 -1.3990 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 -2.0530 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 -1.8230 -3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -1.0170 -4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2330 -2.3650 -3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -1.5880 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -1.1510 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7400 -0.0160 1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 -2.0750 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 2.0440 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -0.3890 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 1.9850 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.9690 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -2.3190 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 0.0590 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 -2.1630 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -0.7010 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -2.7100 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 0.0450 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -1.2820 -5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -1.2310 -4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6340 -2.9180 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 -3.0310 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9010 -1.5400 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 -3.0490 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -2.1900 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -1.6550 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 6 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 12 2 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END > 309 $$$$ 310 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.3460 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0390 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.7550 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 1.4000 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -0.0190 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.3970 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 1.8290 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 0.7130 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 0.7530 -0.0220 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4240 2.0820 -0.5010 N 0 0 3 0 0 0 0 0 0 0 0 0 5.7910 3.1640 0.2520 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2910 3.2270 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 0.6090 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 3.0580 1.7410 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7170 1.6680 2.2630 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1110 1.5470 3.7360 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6020 1.8590 3.8900 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8650 3.1670 3.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 3.3130 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 3.8100 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 1.8030 5.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 2.5390 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 1.5180 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 4.1030 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -0.0360 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 0.2180 4.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 2.3200 4.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 -1.7810 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 2.2260 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 3.1150 4.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 2.9460 4.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 3.9640 5.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.8510 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5780 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.8350 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 3.1770 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 3.6880 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 3.8170 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -0.3860 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 0.7700 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 1.1250 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 2.5960 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 4.3250 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 0.8390 5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0620 1.9320 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 2.6010 5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 2.3920 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 3.5570 4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 0.0680 5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -2.1130 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -1.8390 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -2.4210 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 2.0350 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 3.2390 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7850 1.5120 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 1.9390 5.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 3.6740 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 3.1040 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 3 6 2 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 28 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 27 50 1 0 0 0 0 28 31 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END > 310 $$$$ 311 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6060 -0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 2.1360 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 1.4600 -0.0180 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3530 -0.0350 0.3400 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6080 -0.6300 -0.3470 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9960 0.4210 -1.4040 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0140 1.4700 -1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -0.2060 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -0.6930 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -1.2680 -4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -1.3560 -5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -0.8700 -4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -0.6520 0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -0.8030 0.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 -1.8060 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 -2.0460 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -2.5160 -0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -0.2990 -3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 2.0030 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 3.2160 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 1.9590 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.1990 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -1.5800 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 0.8250 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -0.6240 -2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -1.6480 -4.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -1.8050 -6.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -0.9390 -5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 -1.3110 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 -3.0480 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -1.9510 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 0.0810 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 15 2 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 20 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 20 34 1 0 0 0 0 M END > 311 $$$$ 312 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0180 2.3790 -0.2720 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2140 0.8660 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 0.2010 0.8960 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5120 2.6280 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 2.0150 0.9840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0000 0.5070 0.8290 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8170 -0.2780 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -0.0180 1.5440 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5510 -0.3580 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7900 -0.0710 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 1.3470 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 1.4620 1.7690 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0940 1.7010 1.3780 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4760 3.1540 1.6480 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4780 4.0640 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 3.8170 1.2430 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7240 2.3480 0.9080 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4980 2.9450 -1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -1.3140 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.2250 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 4.7100 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 3.4460 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 3.2400 -1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 4.9480 0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 -0.9020 -0.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 2.1990 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 2.5450 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -0.6360 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 1.7700 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 1.0470 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 5.9130 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 6.8950 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 6.2080 2.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 2.8290 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 0.6630 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 0.4480 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.5460 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 0.0050 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -1.3530 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 1.3740 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 2.0310 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 3.3540 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 4.0390 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 3.9040 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -1.6770 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8160 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -1.5250 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 3.2660 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 4.4860 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 2.7920 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 2.3710 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 2.0280 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 3.6140 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 1.2430 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 2.8430 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 1.4410 3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 6.4550 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 7.1340 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 7.8050 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 18 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 23 2 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 2 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 43 1 0 0 0 0 17 26 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 21 31 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END > 312 $$$$ 313 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 108112 0 0 1 0 0 0 0 0999 V2000 -0.1140 2.9740 3.3620 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1570 1.4440 3.4160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2940 3.4240 2.9630 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6380 2.8440 1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 1.4150 1.7050 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2680 0.8840 2.0550 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7390 0.9760 4.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -0.5430 2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 4.9490 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 5.3770 2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 3.4450 2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 2.4760 2.8780 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9570 2.6390 2.5370 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6890 1.5270 3.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 0.2650 2.5140 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9680 1.1500 2.3000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8210 0.0060 2.8540 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6030 0.9550 2.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 2.7000 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 2.4720 4.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 -0.7700 3.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 -0.8090 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2710 -1.7210 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5970 -1.7580 2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0600 -0.8880 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 0.0220 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 0.0590 1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5060 -0.9310 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6500 -1.8130 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0560 -1.8550 -0.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4230 -2.5760 -1.2240 C 0 0 0 0 0 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0 0 0 0 5.9570 -3.1810 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 0.4240 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -3.0450 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -2.0980 6.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -0.3200 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 -2.1640 7.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.2740 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -1.4940 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -0.7950 7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -1.0910 10.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.9290 9.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.6470 7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -3.8140 11.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -2.2210 11.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -2.8800 13.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 11 1 0 0 0 0 1 58 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 60 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 61 1 0 0 0 0 6 8 1 0 0 0 0 6 62 1 0 0 0 0 7 63 1 0 0 0 0 8 64 1 0 0 0 0 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0 0 39 93 1 0 0 0 0 40 42 1 0 0 0 0 40 94 1 0 0 0 0 41 95 1 0 0 0 0 42 96 1 0 0 0 0 43 44 1 0 0 0 0 43 97 1 0 0 0 0 43 98 1 0 0 0 0 44 47 1 0 0 0 0 45 99 1 0 0 0 0 46 47 1 0 0 0 0 46 49 2 0 0 0 0 46100 1 0 0 0 0 47 48 2 0 0 0 0 49 50 1 0 0 0 0 49101 1 0 0 0 0 50 51 1 0 0 0 0 50 55 2 0 0 0 0 51 52 2 0 0 0 0 51102 1 0 0 0 0 52 53 1 0 0 0 0 52103 1 0 0 0 0 53 54 2 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 54104 1 0 0 0 0 55105 1 0 0 0 0 56 57 1 0 0 0 0 57106 1 0 0 0 0 57107 1 0 0 0 0 57108 1 0 0 0 0 M END > 313 $$$$ 314 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5400 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3120 0.7180 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 1.9980 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3740 -0.3770 -0.5480 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8980 -2.6770 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -1.9970 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -1.7260 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -2.0450 1.4580 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2410 -0.5260 1.3960 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0280 -0.9200 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -0.3780 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.0020 1.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -0.3330 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 2.0610 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 2.7840 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.2610 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -2.6820 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -3.4240 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -0.6760 3.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 3.5060 -1.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 4.1240 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 5.6230 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 3.4790 -3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.9020 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 0.8390 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 0.4750 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 2.5770 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -3.7350 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -2.5750 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -1.0570 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -2.6520 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.4460 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.2150 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 1.7900 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 1.6190 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 3.0860 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -2.4960 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -3.6560 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -3.4460 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -4.3460 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 6.0830 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 5.8970 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 5.9720 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 16 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 18 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 33 1 0 0 0 0 10 13 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 11 20 2 0 0 0 0 15 21 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 19 2 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END > 314 $$$$ 315 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 70 73 0 0 1 0 0 0 0 0999 V2000 1.3310 4.4910 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 3.0910 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 2.2340 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 2.7420 0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 0.9030 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -1.2850 -1.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7120 -2.1310 -1.4820 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4730 -2.2620 -0.1590 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8010 -0.8650 0.3730 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5920 -0.1210 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 0.0740 -0.6800 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7750 -1.0950 -2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -3.4290 -1.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -2.9880 -0.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -0.9780 1.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 0.1700 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 1.3810 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 2.5580 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 0.1250 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 1.2940 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 2.5200 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 3.7480 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 3.6150 5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 2.3790 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 1.2660 5.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 4.7130 5.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 4.8390 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 3.7400 1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -1.1950 4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -1.4710 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -2.5970 4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 -3.5620 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -2.9270 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 2.2580 7.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 1.5380 8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 1.4280 9.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0650 2.0320 9.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 2.7490 8.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 2.8590 7.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6880 1.9210 10.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 4.6200 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 5.2090 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 4.6540 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 0.4210 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 0.9760 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -1.7950 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -1.6460 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -2.7920 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -0.3510 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 0.6000 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.9180 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -4.0190 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -3.1090 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 1.4030 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3270 5.5420 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 4.1850 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -1.9890 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 -1.1570 4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 -0.7400 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -4.1950 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -4.1830 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -3.0050 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -2.1170 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -3.0510 5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -3.8520 6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2330 1.0690 7.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 0.8720 10.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6260 3.2170 8.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5070 3.4160 6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2720 1.1540 10.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 5 11 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 18 21 2 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 26 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 66 1 0 0 0 0 36 37 1 0 0 0 0 36 67 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 68 1 0 0 0 0 39 69 1 0 0 0 0 40 70 1 0 0 0 0 M END > 315 $$$$ 316 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 25 27 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3910 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 2.1000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4390 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 0.0380 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -0.5930 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 0.0880 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 1.4980 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 2.1930 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 -0.5260 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.6880 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.9310 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -2.1700 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -2.0690 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -3.3820 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -3.3530 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -4.4450 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9130 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.1800 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 2.0230 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 3.2730 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -2.8860 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -2.8280 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -4.3730 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -2.8360 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 M END > 316 $$$$ 317 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3950 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.0380 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -2.7530 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -2.1330 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -0.7770 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.0320 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4140 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 2.1560 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 1.5140 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 0.2070 -0.4680 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7240 -0.7230 -0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9250 2.4260 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 1.2060 1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.4850 -1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -0.3360 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -0.1150 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -1.2610 -2.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -0.9260 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 1.0310 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -2.0720 -4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -1.2170 1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -2.4360 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -3.0160 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -3.0690 0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -3.9700 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9240 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -2.7340 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.2830 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -0.2650 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -1.5640 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 3.3610 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 1.9320 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 2.6350 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 0.5480 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 0.7160 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 2.1350 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -0.7640 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 1.9170 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 0.7670 -5.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 1.2390 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 -2.6210 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5510 -1.6850 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -2.7400 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -2.3060 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -3.2140 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -3.9460 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 29 1 0 0 0 0 2 10 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 14 24 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END > 317 $$$$ 318 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3960 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.6760 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.1010 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 2.1200 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 3.3320 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 1.3550 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0310 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.4320 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 0.6090 -0.4510 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8160 1.8980 -0.0420 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9180 0.5180 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 2.3510 1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 -0.8230 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 1.6600 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 0.6200 1.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 3.6780 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 4.2090 2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 5.5190 3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 6.4570 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 3.2710 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 4.4350 0.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.7560 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 3.1810 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 1.1650 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 1.9400 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 0.4060 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 0.5660 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 2.6820 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -0.9010 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 -0.8880 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -1.6360 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3510 2.6150 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7830 1.5950 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 1.5820 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -0.0730 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 5.9090 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 6.3670 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 6.2020 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 7.4820 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 3.1400 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 3.6880 4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 2.3050 3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 9 2 0 0 0 0 3 25 1 0 0 0 0 4 8 2 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 M END > 318 $$$$ 319 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4020 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6760 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 2.1250 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 1.5100 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 3.6320 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4280 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.0330 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.4260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 0.6160 -0.4480 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8170 1.9040 -0.0420 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9200 0.5280 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 2.3590 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 -0.8120 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 1.6710 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 0.6310 1.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 3.6860 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 4.2190 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 5.5290 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 6.4660 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 3.2820 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 4.4420 0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -0.6990 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -2.1250 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.7560 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 3.1860 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 4.0030 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 3.9960 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 3.9860 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 0.5720 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 2.6870 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 -0.8900 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 -0.8740 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -1.6260 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 2.6260 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7840 1.6090 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 1.5930 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5340 0.5830 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 5.9210 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 7.4910 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 6.3750 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 6.2090 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 3.1530 3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 3.7000 4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 2.3160 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.4580 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -2.5560 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -2.4480 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 9 2 0 0 0 0 3 26 1 0 0 0 0 4 8 2 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END > 319 $$$$ 320 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.3780 1.1840 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.7520 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.0160 0.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -0.3640 0.4370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5630 -1.0220 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -1.9420 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.3060 0.1690 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7310 -0.9220 1.4160 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4840 -1.2200 -0.9890 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8640 -1.7670 -0.6130 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0020 -1.6050 0.9050 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0540 -3.0510 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -3.8260 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -3.2570 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -2.3080 -1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 2.6940 -0.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -1.1630 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -0.8210 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -1.0610 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -3.8380 -1.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 0.0460 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.8430 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -2.4150 -3.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -3.9760 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 1.5920 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 1.3650 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -1.6010 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -0.2790 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -2.7500 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.3280 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -0.6510 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -3.3680 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -3.1540 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -0.8630 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -2.2270 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -0.9690 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 0.1780 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -1.3390 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -0.7430 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8570 -1.2180 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -1.4690 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 0.0070 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -0.3310 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -4.2230 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -4.8480 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -3.6760 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 16 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 20 2 0 0 0 0 15 22 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 M END > 320 $$$$ 321 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.6140 1.6750 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.1690 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -0.5430 -0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.3980 -0.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.9890 -0.4480 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4260 -2.5160 1.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2960 -3.7870 1.0250 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8190 -3.9710 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -2.6670 -0.9170 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0640 -2.8360 1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -3.6240 1.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -2.7910 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -3.4070 -2.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -5.8860 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -6.9890 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 -6.9100 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -4.7000 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -4.6120 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -5.7320 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -5.6580 4.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -3.3550 3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -3.1160 5.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -1.9730 5.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -1.7530 7.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -2.6660 7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -3.8040 6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -4.0300 5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 -2.5120 3.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -4.6960 7.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -0.6410 7.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -8.1490 1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 -9.2450 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 2.0010 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 2.0390 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 2.0720 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.3100 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -1.7810 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -4.6470 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -2.1110 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -3.1720 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -3.4020 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -1.8000 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -3.5180 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -5.9550 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -7.7730 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 -5.4500 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -1.2620 5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -2.4920 8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -4.9150 5.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -4.5160 7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 0.1200 7.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -8.9670 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -9.4950 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 -10.1080 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 19 2 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 28 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END > 321 $$$$ 322 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.4330 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1520 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 3.5830 -0.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 4.3490 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 3.6490 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.4710 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0740 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 1.5250 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.2000 0.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7980 0.0610 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -0.6390 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.9960 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 -2.6380 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -1.9350 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -0.5880 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.6400 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.0510 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.8560 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.1070 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -1.9790 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 4.1290 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 3.5160 -1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 5.5020 -1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 2.2020 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.9650 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 4.4460 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 5.3420 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 3.9870 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 3.9360 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 1.6330 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 1.9980 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -2.5440 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -3.6910 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -2.4410 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -0.0450 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -2.2370 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.9390 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 5.8520 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 6.1910 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 5.4570 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 2 0 0 0 0 1 25 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 11 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END > 322 $$$$ 323 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 146153 0 0 1 0 0 0 0 0999 V2000 -2.4590 1.8820 1.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5200 0.4540 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.1280 -0.0260 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7390 0.2440 -0.3860 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6060 1.7700 -0.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0300 2.3340 0.9440 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9780 3.7620 0.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 2.1260 -0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.2880 -1.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -1.6500 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.0010 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 2.3590 2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 4.6810 5.5290 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3930 4.0620 4.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 2.6380 4.2810 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9180 2.2380 4.6970 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2290 2.8450 6.0680 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0500 4.3640 5.9950 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4680 6.1190 5.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 4.9340 7.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 2.5390 6.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 0.8140 4.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 2.0860 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 7.2640 11.7260 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1890 6.9980 10.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4620 7.6400 10.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 7.1430 11.5290 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7050 7.4250 12.8780 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3290 6.7530 12.9050 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2680 9.7580 4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 8.5680 3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 10.0400 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 10.2620 3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 8.0550 4.9510 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5290 8.2870 4.5950 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5230 8.1590 7.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 8.1680 7.1650 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6780 7.7970 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 7.0640 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 6.4450 6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 7.2880 8.1770 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1850 7.1880 7.7650 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4430 7.0810 10.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 7.8450 9.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 7.2720 10.1390 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1100 6.5570 8.8110 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5610 6.7990 8.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 6.2940 9.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 7.0860 10.7120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8930 6.9520 11.2290 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2320 6.6000 11.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 5.0510 8.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 5.8980 8.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 11.7680 2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 9.5490 1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 5.5840 11.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 8.0100 12.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 9.6120 7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 6.5720 5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 5.7930 4.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 8.7650 6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 7.0690 14.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 6.8990 13.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 7.7340 13.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5890 5.7140 11.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6390 5.3290 10.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 3.8630 10.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3530 6.1580 10.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 7.6840 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 8.3640 9.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 8.2120 7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 2.2850 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 0.2490 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.1670 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 2.1770 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 1.9660 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 4.1880 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 3.0790 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -0.0910 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -2.0990 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -2.0170 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -2.9530 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 4.2990 6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 2.2290 4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 2.6120 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 2.4330 6.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 4.7810 5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 5.8950 7.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 2.8930 7.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 0.4900 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 2.5610 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 1.0090 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 8.3380 11.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9130 7.4030 9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 8.7180 10.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3290 7.6640 11.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 8.5010 13.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 5.6720 12.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 9.9040 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 10.3650 5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 8.4520 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 7.9690 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 10.3680 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 10.6390 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 7.1750 7.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 8.7800 8.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 6.8950 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 5.3890 6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 6.5430 6.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 7.5190 11.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 6.0380 10.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 8.8920 9.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 7.7360 9.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 6.2600 7.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 7.8660 8.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 5.2320 9.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 6.4540 9.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 8.1410 10.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 4.6280 7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 4.6000 9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 4.8480 9.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 5.5040 7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 5.2250 8.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 5.9800 8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 11.9420 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 12.1440 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 12.2880 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 8.4770 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 9.9200 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 9.7420 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 4.8050 11.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 5.4740 12.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 5.4950 12.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 9.0020 11.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 7.9720 12.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 9.8770 8.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 9.6900 7.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 10.2910 6.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 9.8270 6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 8.6570 6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 6.6800 14.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4040 7.2760 13.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 8.3580 14.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 3.2720 10.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8880 3.6240 9.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9180 3.6320 10.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 72 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 73 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 74 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 75 1 0 0 0 0 6 7 1 0 0 0 0 6 76 1 0 0 0 0 7 77 1 0 0 0 0 8 78 1 0 0 0 0 9 79 1 0 0 0 0 10 11 1 0 0 0 0 10 80 1 0 0 0 0 10 81 1 0 0 0 0 11 82 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 83 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 84 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 85 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 86 1 0 0 0 0 18 20 1 0 0 0 0 18 87 1 0 0 0 0 19 59 1 0 0 0 0 20 88 1 0 0 0 0 21 89 1 0 0 0 0 22 90 1 0 0 0 0 23 91 1 0 0 0 0 23 92 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 51 1 0 0 0 0 24 93 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 94 1 0 0 0 0 26 95 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 27 96 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 97 1 0 0 0 0 29 62 1 0 0 0 0 29 98 1 0 0 0 0 30 33 1 0 0 0 0 30 35 1 0 0 0 0 30 99 1 0 0 0 0 30100 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31101 1 0 0 0 0 31102 1 0 0 0 0 32 33 1 0 0 0 0 32103 1 0 0 0 0 32104 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 34 61 1 0 0 0 0 35 38 1 0 0 0 0 35 69 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 36105 1 0 0 0 0 36106 1 0 0 0 0 37 38 1 0 0 0 0 37 41 1 0 0 0 0 37 58 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 39107 1 0 0 0 0 40 42 1 0 0 0 0 40108 1 0 0 0 0 40109 1 0 0 0 0 41 42 1 0 0 0 0 41 44 1 0 0 0 0 41 53 1 0 0 0 0 42 46 1 0 0 0 0 42 71 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43110 1 0 0 0 0 43111 1 0 0 0 0 44112 1 0 0 0 0 44113 1 0 0 0 0 45 46 1 0 0 0 0 45 50 1 0 0 0 0 45 70 1 0 0 0 0 46 47 1 0 0 0 0 46 52 1 0 0 0 0 47 48 1 0 0 0 0 47114 1 0 0 0 0 47115 1 0 0 0 0 48 49 1 0 0 0 0 48116 1 0 0 0 0 48117 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49118 1 0 0 0 0 50 56 1 0 0 0 0 50 57 1 0 0 0 0 52119 1 0 0 0 0 52120 1 0 0 0 0 52121 1 0 0 0 0 53122 1 0 0 0 0 53123 1 0 0 0 0 53124 1 0 0 0 0 54125 1 0 0 0 0 54126 1 0 0 0 0 54127 1 0 0 0 0 55128 1 0 0 0 0 55129 1 0 0 0 0 55130 1 0 0 0 0 56131 1 0 0 0 0 56132 1 0 0 0 0 56133 1 0 0 0 0 57 64 1 0 0 0 0 57134 1 0 0 0 0 57135 1 0 0 0 0 58136 1 0 0 0 0 58137 1 0 0 0 0 58138 1 0 0 0 0 59 60 2 0 0 0 0 61139 1 0 0 0 0 61140 1 0 0 0 0 62141 1 0 0 0 0 63142 1 0 0 0 0 64143 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 2 0 0 0 0 67144 1 0 0 0 0 67145 1 0 0 0 0 67146 1 0 0 0 0 M END > 323 $$$$ 324 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.5730 -1.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0910 -0.1240 -1.2070 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1470 1.4060 -1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 1.9530 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5650 -2.0990 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3810 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 1.8350 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.6450 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.5310 -1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 1.8860 1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 1.5900 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 2.0080 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 1.7080 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 0.9890 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 0.5730 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 0.8770 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -3.8520 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -4.3740 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -4.6220 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 0.6930 1.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.2380 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -0.4940 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 1.7740 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 1.6260 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.5330 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -2.4280 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 3.7960 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 2.7950 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -0.3990 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 2.5670 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 2.0320 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 0.0140 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 0.5520 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -3.5380 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -5.0340 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -4.9290 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 1.3620 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 40 1 0 0 0 0 M END > 324 $$$$ 325 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.5730 -1.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0910 -0.1240 -1.2070 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1470 1.4060 -1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 1.9530 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7260 3.5260 2.6130 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6220 1.9770 2.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0710 1.5400 1.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7300 2.1230 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 3.2400 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 3.8830 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 3.7000 3.6780 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0390 1.5310 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 2.4740 3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 1.6320 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 1.8860 1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 4.8750 3.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 4.8270 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 5.5010 1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 0.1880 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 0.1070 2.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -1.0330 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 -1.9350 1.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 -1.1900 2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -2.0990 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.5310 -1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 1.8350 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3810 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.6450 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 0.4560 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 4.0760 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -3.8520 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -4.3740 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -4.6220 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.2380 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -0.4940 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 1.7740 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 1.6260 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 3.6210 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 3.7910 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 2.3880 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 0.0650 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -0.6010 2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 -0.2800 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6830 -1.3670 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -2.0340 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.5330 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -2.4280 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 2.7950 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 3.7960 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -0.3990 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -3.5380 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -5.0340 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -4.9290 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 17 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 39 1 0 0 0 0 6 29 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 19 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 33 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 M END > 325 $$$$ 326 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 138145 0 0 1 0 0 0 0 0999 V2000 -2.9540 4.2740 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 3.1200 -3.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 5.3580 -4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -4.0730 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -2.6680 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.6460 -2.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 0.6360 -6.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 0.8410 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 0.4960 -4.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 0.7210 -2.8690 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8390 -0.3200 -2.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1550 -0.0270 -0.8830 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6720 1.3000 -0.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 2.3200 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 2.1200 -2.6700 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1270 -0.9610 -0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -8.7700 1.5870 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6260 -7.3090 1.6490 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8520 -6.3970 1.5640 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7540 -6.7120 2.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 -8.0520 2.5940 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0780 -9.0310 2.7200 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4410 -5.0330 1.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2200 -8.2660 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3680 -7.4340 3.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5640 -10.3720 2.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 -9.6300 1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7500 -7.0350 0.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.0440 -0.7420 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4840 -1.9170 5.2720 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.9530 -3.1300 4.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.1880 -2.8110 3.9840 C 0 0 1 0 0 0 0 0 0 0 0 0 -14.9070 -1.4220 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 0.1330 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -0.8460 0.9870 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7620 -2.2330 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -0.3490 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -1.7600 0.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0310 -2.7840 0.9140 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4970 -4.0920 1.4970 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.3220 -4.0210 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3930 -1.9240 1.7680 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.5370 -3.1420 2.6800 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.3670 -0.8040 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0400 -0.6200 2.2520 C 0 0 0 0 0 0 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0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 77 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 78 1 0 0 0 0 14 79 1 0 0 0 0 15 80 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 27 1 0 0 0 0 17 81 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 18 82 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 83 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 84 1 0 0 0 0 22 26 1 0 0 0 0 22 85 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 86 1 0 0 0 0 24 87 1 0 0 0 0 25 88 1 0 0 0 0 26 89 1 0 0 0 0 27 90 1 0 0 0 0 28 91 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 29 92 1 0 0 0 0 29 93 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 94 1 0 0 0 0 33 95 1 0 0 0 0 33 96 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 34 97 1 0 0 0 0 34 98 1 0 0 0 0 35 36 1 0 0 0 0 35 99 1 0 0 0 0 36 39 1 0 0 0 0 36 51 1 0 0 0 0 36 52 1 0 0 0 0 37 38 1 0 0 0 0 37100 1 0 0 0 0 37101 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38 53 1 0 0 0 0 39 40 1 0 0 0 0 39102 1 0 0 0 0 40 41 1 0 0 0 0 40103 1 0 0 0 0 41 43 1 0 0 0 0 41104 1 0 0 0 0 41105 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 42 53 1 0 0 0 0 43 47 1 0 0 0 0 43106 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44107 1 0 0 0 0 44108 1 0 0 0 0 45109 1 0 0 0 0 45110 1 0 0 0 0 46 47 1 0 0 0 0 46 50 1 0 0 0 0 46 57 1 0 0 0 0 47 48 1 0 0 0 0 47 54 1 0 0 0 0 48 49 1 0 0 0 0 48111 1 0 0 0 0 48112 1 0 0 0 0 49 50 1 0 0 0 0 49 55 1 0 0 0 0 49113 1 0 0 0 0 50 65 1 0 0 0 0 51114 1 0 0 0 0 51115 1 0 0 0 0 51116 1 0 0 0 0 52117 1 0 0 0 0 52118 1 0 0 0 0 52119 1 0 0 0 0 53120 1 0 0 0 0 53121 1 0 0 0 0 54122 1 0 0 0 0 54123 1 0 0 0 0 54124 1 0 0 0 0 55125 1 0 0 0 0 56126 1 0 0 0 0 56127 1 0 0 0 0 56128 1 0 0 0 0 57129 1 0 0 0 0 57130 1 0 0 0 0 57131 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 58 61 1 0 0 0 0 59132 1 0 0 0 0 59133 1 0 0 0 0 59134 1 0 0 0 0 60135 1 0 0 0 0 60136 1 0 0 0 0 60137 1 0 0 0 0 61138 1 0 0 0 0 M END > 326 $$$$ 327 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -0.4270 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 0.7180 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 9.1030 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 7.9740 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 6.6490 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 5.5200 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 10.4800 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 4.1430 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 3.1680 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 11.4390 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 12.8880 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 13.6240 -0.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 14.9380 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 15.4570 -0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 15.7670 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -0.6430 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -1.4530 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 0.7420 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 10.7440 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 3.8790 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 3.4310 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 11.1760 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 13.3060 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 12.9680 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 15.1310 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 16.5540 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 16.2160 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 12 1 0 0 0 0 6 7 3 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 3 0 0 0 0 9 11 1 0 0 0 0 10 13 2 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 M END > 327 $$$$ 328 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 95 98 0 0 1 0 0 0 0 0999 V2000 0.3090 2.6360 0.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1330 1.6290 3.1760 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1800 2.0890 2.4620 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0090 2.0200 0.9120 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4620 1.1350 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 1.3050 2.9320 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3100 0.1200 2.9110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2070 1.5300 -0.2180 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7370 -0.0580 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 0.6810 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -0.9080 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.6420 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.8340 -0.7670 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8560 -1.9560 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 3.5480 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -0.2970 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 1.5280 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.9370 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -0.3960 3.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 1.7980 4.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 1.9890 4.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -1.4390 -1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 3.6200 -0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 2.2590 0.8700 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2120 2.5720 0.1700 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5680 4.0480 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 3.5940 1.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 2.2050 -1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 4.8510 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 5.9200 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 5.1030 0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 2.6500 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 3.2400 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 2.4140 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 2.2110 -0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 2.8920 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 3.7100 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 2.8500 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 1.2240 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 1.8590 6.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 0.0260 4.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 2.0730 5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 2.1700 4.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 2.2590 6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -1.2920 4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.7840 5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -1.7050 4.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -2.7580 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -3.4470 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -3.3920 -1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 3.1230 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 2.2860 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 0.1890 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 1.0430 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 0.3110 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.3960 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 1.0140 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 0.6970 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -1.3970 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -1.5750 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -2.8610 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -2.1860 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 4.1150 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 3.9930 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 3.5690 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -0.6620 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 0.2200 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -1.1390 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 0.9540 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 1.8040 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 2.4300 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 2.1070 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 4.6800 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 4.5090 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 5.4890 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 6.7170 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 6.3260 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 1.8700 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 1.8280 -3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 3.3710 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 3.5580 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 3.3990 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 4.7660 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 2.9380 6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2920 1.6390 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 1.4590 7.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 1.2990 7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 2.9540 7.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 2.6600 7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -1.3030 5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.5390 6.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -2.8640 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -3.4260 -3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -4.4810 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.9320 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 1 23 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 20 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 4 18 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 53 1 0 0 0 0 5 54 1 0 0 0 0 6 21 1 0 0 0 0 6 55 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 56 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 57 1 0 0 0 0 12 58 1 0 0 0 0 13 22 1 0 0 0 0 13 59 1 0 0 0 0 14 60 1 0 0 0 0 14 61 1 0 0 0 0 14 62 1 0 0 0 0 15 63 1 0 0 0 0 15 64 1 0 0 0 0 15 65 1 0 0 0 0 16 66 1 0 0 0 0 16 67 1 0 0 0 0 16 68 1 0 0 0 0 17 69 1 0 0 0 0 17 70 1 0 0 0 0 17 71 1 0 0 0 0 19 45 1 0 0 0 0 20 42 1 0 0 0 0 21 39 1 0 0 0 0 22 48 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 72 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 37 83 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 84 1 0 0 0 0 40 85 1 0 0 0 0 40 86 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 44 87 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 45 46 1 0 0 0 0 45 47 2 0 0 0 0 46 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 48 49 1 0 0 0 0 48 50 2 0 0 0 0 49 93 1 0 0 0 0 49 94 1 0 0 0 0 49 95 1 0 0 0 0 M END > 328 $$$$ 329 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.6710 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.0530 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.3750 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0260 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -0.7350 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 0.0360 -0.0720 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7810 1.4560 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1750 0.1100 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9990 2.2380 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 1.4770 1.8770 N 0 0 3 0 0 0 0 0 0 0 0 0 5.1020 0.0820 1.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3960 -0.6840 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 -0.6140 3.2320 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8390 0.8580 3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 1.5660 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -1.8900 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -1.2380 3.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -1.8180 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -2.4840 5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 -1.8050 5.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -0.3900 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8960 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5630 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 3.1330 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -1.6590 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -0.9860 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 -0.4660 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 1.9790 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 1.4200 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 3.1760 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 3.2780 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 1.8170 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 -1.7260 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 -0.2410 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6520 -1.1300 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 0.9280 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 1.3240 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 2.6140 3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 1.0960 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -3.5320 5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 -2.4180 7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -1.9850 5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 6 1 0 0 0 0 3 18 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M END > 329 $$$$ 330 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -0.0820 1.3370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0920 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 3.4090 0.1430 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7370 3.9560 0.0820 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3860 3.5120 -1.2320 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3440 1.9840 -1.3210 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9900 1.5390 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 1.8850 0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7160 3.7570 1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 5.3840 0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 3.9550 -1.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 1.5640 -2.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7270 0.3360 -3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -2.3980 -4.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -3.7200 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -4.5020 -5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -4.2820 -4.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 0.1470 -2.7090 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9640 -0.3610 -1.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -0.0310 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -0.1900 -4.1160 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8860 0.4240 -4.3600 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5140 -0.4780 -5.4450 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7860 -1.8310 -5.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -1.7090 -4.2390 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8020 1.4560 -4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 0.1570 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -2.2670 -2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 0.6680 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6180 1.0500 -4.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8120 0.6090 -2.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0100 1.3700 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 0.1160 -6.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 -0.1400 -7.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2080 -0.8390 -7.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 0.4420 -9.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.6960 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.6760 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -0.5090 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 3.8360 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 3.5680 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 3.9410 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 1.5560 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.4560 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 4.7090 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 5.7980 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 3.7080 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.5140 -6.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -5.5240 -4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -4.0340 -4.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -0.3140 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 -0.0650 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5770 -0.6150 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -2.0400 -6.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -2.6250 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -1.7790 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -2.0780 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -3.3400 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2960 1.6610 -5.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2060 2.1950 -3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5890 0.4990 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 1.4130 -9.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -0.2280 -9.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 0.5630 -9.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 46 1 0 0 0 0 11 47 1 0 0 0 0 12 18 1 0 0 0 0 13 20 2 0 0 0 0 13 22 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 33 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 32 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 M END > 330 $$$$ 331 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 96 0 0 1 0 0 0 0 0999 V2000 -0.2050 1.5340 -0.3610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2480 2.0480 -0.1990 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7620 2.3820 -1.6210 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1210 -0.0120 -0.3450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3830 -0.3130 -0.5350 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8520 -1.6720 -0.0890 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2970 -2.1490 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -1.9600 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -0.4680 1.0660 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7510 -0.1060 -1.9960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2920 1.2590 -2.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0840 1.3270 -3.8720 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5000 0.9150 -3.4020 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2660 -0.1010 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 0.8100 0.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0500 2.1270 0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 0.3340 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.5450 1.7280 N 0 0 3 0 0 0 0 0 0 0 0 0 2.3560 1.4550 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 0.9710 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -2.5150 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -1.6660 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.6440 -2.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 3.3640 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 4.7310 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 6.0770 -1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 4.6310 -0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -2.9350 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 2.5730 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 2.1630 -2.7290 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0300 2.6440 -4.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 2.8760 -5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 4.1570 -6.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 2.0330 -5.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 4.3560 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 5.5530 -7.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 6.5560 -7.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 6.3650 -6.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 5.1750 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -0.2980 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -0.7310 2.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 3.2430 -3.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -0.6130 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 4.0610 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 0.5020 -4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.8610 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 2.9110 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -0.4830 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.4000 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -3.2110 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -1.5930 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -2.2940 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -0.9010 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 1.2850 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 0.5840 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 0.2160 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -1.0940 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 0.8630 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 1.2820 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -0.2340 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 1.4740 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 2.4590 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 0.9520 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -0.0320 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 1.6480 4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 4.0820 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 3.2000 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 3.7530 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 5.9570 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 6.5100 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 6.7360 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.6640 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -3.2620 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -2.8470 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 3.6600 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 2.1060 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 1.8980 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 3.5740 -7.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 5.7090 -8.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 7.4920 -8.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 7.1520 -6.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 5.0270 -5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 0.7520 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -0.8960 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -0.9620 3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 0.4310 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -1.2170 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 4.4950 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 3.4520 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 4.8580 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 47 1 0 0 0 0 3 11 1 0 0 0 0 3 23 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 52 1 0 0 0 0 9 17 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 45 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 18 1 0 0 0 0 15 58 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 22 28 1 0 0 0 0 23 25 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 30 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 30 42 1 0 0 0 0 30 77 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 35 1 0 0 0 0 33 39 2 0 0 0 0 35 36 2 0 0 0 0 35 78 1 0 0 0 0 36 37 1 0 0 0 0 36 79 1 0 0 0 0 37 38 2 0 0 0 0 37 80 1 0 0 0 0 38 39 1 0 0 0 0 38 81 1 0 0 0 0 39 82 1 0 0 0 0 40 41 1 0 0 0 0 40 83 1 0 0 0 0 40 84 1 0 0 0 0 41 43 1 0 0 0 0 42 44 1 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 43 87 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 44 90 1 0 0 0 0 M END > 331 $$$$ 332 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 3.3480 -1.6040 -3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -2.6380 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -2.5960 -1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -3.5060 -3.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -4.8220 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -3.6270 -0.5180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5470 -3.0380 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -5.8880 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -5.3160 1.9290 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0530 -4.1040 1.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6480 -3.5520 3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -4.6120 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -6.3790 2.7210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5900 -5.8940 4.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1460 -8.7360 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -7.6320 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -8.2560 4.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3200 -6.9980 4.5970 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9990 -6.5140 5.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -7.6230 6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -4.9820 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -5.6020 5.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -8.4380 7.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -2.1560 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -2.1100 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -7.3050 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -8.5450 7.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -7.9820 8.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -9.3240 5.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8960 -8.8150 6.8080 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5820 -10.0750 7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -11.1880 6.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -10.6560 5.8570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2470 -11.6330 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -12.1700 4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -11.9880 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -1.6520 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -1.8000 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -0.6120 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -5.2580 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -4.5120 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -3.9390 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -6.1810 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -6.7550 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -4.5030 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -3.3130 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.6510 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -4.2210 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -4.7960 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -6.6810 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -9.0260 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -9.6010 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -7.9830 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -7.4460 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -8.0390 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -6.1150 6.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -5.7030 5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -7.2550 7.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -7.9190 5.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -4.3750 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -4.4280 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -5.9050 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -5.4550 6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -6.4440 5.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -4.7010 4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -1.2810 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -1.8340 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -2.7220 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -2.6930 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -1.6590 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.3260 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -7.6440 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -8.0860 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -6.4040 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -7.7530 9.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -9.5460 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -9.9970 8.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -10.2280 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -11.4350 7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -12.0750 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -10.5050 6.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -12.8670 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -11.9150 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -11.2960 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -13.0050 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -11.9200 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 50 1 0 0 0 0 14 18 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 30 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 23 30 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 28 75 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 29 76 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 33 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 34 1 0 0 0 0 33 81 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 M END > 332 $$$$ 333 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.3510 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.4740 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -0.3370 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 2.4960 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 2.6350 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 2.3400 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 2.2880 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 4.1290 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 2.0140 0.0520 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3770 2.9130 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 2.0550 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 0.9500 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 0.7120 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 1.5650 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 2.6680 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 2.7740 4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 2.8500 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 3.1420 3.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 2.8320 5.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 3.0100 5.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.3040 -0.7590 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2480 3.8750 -0.6910 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1520 4.3330 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 5.1930 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 2.4300 4.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 3.6440 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 0.1130 3.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -0.3590 2.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -0.1560 4.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 1.3190 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 2.2360 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 0.3350 -1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 0.3320 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -0.9330 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -0.9980 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 2.6990 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 4.9930 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 4.3240 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 1.3550 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 3.3320 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 1.8010 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 3.5210 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 3.0960 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 3.1670 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 3.9390 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 5.2550 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 4.5360 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 5.9080 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 5.0160 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 5.5930 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 3.4520 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 4.3840 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 4.0210 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 0.3660 4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -1.0870 4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 0.1610 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 0.6140 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 1.9240 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 3.2350 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 2.2490 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 32 2 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 7 1 0 0 0 0 4 16 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 17 2 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 M END > 333 $$$$ 334 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 0.1700 1.4870 -0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.1600 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.6600 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.9870 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.3550 -0.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -2.8120 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -4.1890 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -4.9550 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 -4.3650 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 -3.0040 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -2.2250 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 1.6420 2.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 0.7100 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -0.6020 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -1.5350 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -2.8560 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 0.9610 3.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -3.8260 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -5.0610 5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 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7.7370 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 7.9330 2.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 8.8780 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -0.2020 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.4450 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -4.6500 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -6.0180 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 -4.9700 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -2.5500 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -1.1620 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.8250 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -1.3120 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -3.6070 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -5.8100 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -6.3120 5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -4.6160 4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -2.4070 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 3.3420 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 4.5570 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 5.4380 4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 5.8830 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 2.6940 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 3.8120 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 2.7730 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.3390 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.8310 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.5850 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 5.1380 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 4.5060 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 3.6310 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 6.6100 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 6.1180 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 5.4280 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 5.3960 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 5.0630 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 4.0250 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 5.4880 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 2.0520 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 2.0660 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 3.0400 5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 8.5120 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 9.6460 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 9.3020 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 5 2 0 0 0 0 3 4 2 0 0 0 0 3 44 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 22 2 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 60 1 0 0 0 0 25 28 1 0 0 0 0 25 37 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 34 1 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 29 36 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 38 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 36 74 1 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 39 75 1 0 0 0 0 39 76 1 0 0 0 0 39 77 1 0 0 0 0 40 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 43 83 1 0 0 0 0 M END > 334 $$$$ 335 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.1020 1.2530 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -0.1330 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.1280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.8290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.3060 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.9050 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -2.0770 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -0.8380 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 1.2670 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 1.9650 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 3.3140 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 2.0430 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 3.4840 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 4.0530 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 5.4100 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 6.1700 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 5.6010 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 4.2620 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -1.7970 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -2.8530 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 1.9910 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -0.8020 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 1.5300 -0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 5.9830 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 2.7610 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 2.9620 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 0.9880 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 2.7120 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 6.4260 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 6.9650 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 6.3930 -1.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -2.8830 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -3.9830 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 7.2190 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 6.2080 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 3.8190 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.7400 -2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -1.1980 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -1.2530 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -3.0630 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -2.2570 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -3.7900 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -1.0010 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 3.3540 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 2.4050 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 3.4960 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 3.6760 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 0.2960 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 1.5220 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 0.4310 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 3.2630 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 2.1190 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 6.9160 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 8.0020 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 6.3690 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 2 0 0 0 0 1 21 1 0 0 0 0 2 4 1 0 0 0 0 2 9 2 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 23 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 25 1 0 0 0 0 21 26 1 0 0 0 0 21 27 1 0 0 0 0 22 43 1 0 0 0 0 24 29 1 0 0 0 0 25 28 2 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END > 335 $$$$ 336 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5550 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4710 1.9660 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 0.6170 -0.0160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0200 0.0160 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.3950 1.4160 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2800 -0.2720 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -1.7470 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 0.2570 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.6880 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -1.4690 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 0.3360 2.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -0.2380 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.4610 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.3150 3.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.9330 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.9240 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 2.5460 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 2.5370 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 0.6700 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.8560 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 0.7670 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.3530 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -1.8860 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -2.0520 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 1.3320 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 0.0490 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -0.2350 -2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -0.3680 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -1.7690 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.4140 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 0.6180 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -0.1530 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.4240 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 M END > 336 $$$$ 337 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 0.9030 1.3780 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 0.0190 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -0.5230 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 0.2770 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 1.6250 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 2.1800 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 4.6990 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 4.2420 1.8780 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6850 3.7840 0.5170 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4460 6.5560 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 5.2230 1.8470 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4790 6.5520 1.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4370 7.6740 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 7.7430 3.1100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5380 6.3610 3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 5.3430 3.2950 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6440 6.0260 -0.9720 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3090 4.8870 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 4.9830 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 6.1940 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7290 7.0880 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 4.0070 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 8.5980 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 6.8860 -0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 6.7880 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 8.0430 4.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 4.8840 2.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 3.2760 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 4.6250 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 4.0470 3.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 5.5280 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 6.6500 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 4.4100 -2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 5.1040 -3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 4.1020 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 2.9190 3.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 3.7730 5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 2.4470 5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 4.5890 5.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 1.9650 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.2640 0.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 6.5280 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5650 7.2020 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 5.6660 -1.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.6060 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -1.5740 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.1520 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 2.2440 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 3.2320 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 4.6660 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 4.1290 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 5.7340 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 3.3680 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 2.9780 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 7.5840 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 5.9720 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 8.5060 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 6.1250 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 6.3520 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 5.6490 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 5.9040 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 7.8020 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 7.5960 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 4.3340 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 3.9620 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 3.0180 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 8.4820 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 9.4760 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 8.8850 3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 4.5950 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 5.2400 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 3.6140 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 6.9460 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 6.2980 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 7.5070 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 3.5630 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 5.9880 -3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 4.5840 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 4.4400 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 1.8480 4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 2.6150 6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 1.9200 6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 7.9460 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1220 7.6910 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 6.4580 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 48 1 0 0 0 0 6 49 1 0 0 0 0 7 35 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 8 53 1 0 0 0 0 9 18 1 0 0 0 0 9 28 1 0 0 0 0 9 54 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 10 55 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 23 2 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 58 1 0 0 0 0 15 59 1 0 0 0 0 16 30 1 0 0 0 0 16 60 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 24 42 1 0 0 0 0 26 69 1 0 0 0 0 27 35 1 0 0 0 0 28 40 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 30 37 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 36 2 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 38 82 1 0 0 0 0 40 41 2 0 0 0 0 42 43 1 0 0 0 0 42 44 2 0 0 0 0 43 83 1 0 0 0 0 43 84 1 0 0 0 0 43 85 1 0 0 0 0 M END > 337 $$$$ 338 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 79 84 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5520 0.0110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4600 1.9910 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9080 2.2020 -1.4680 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4780 -0.3910 -0.2130 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8890 -1.7430 0.3110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3680 -2.1000 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -1.8270 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.3530 1.4610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8250 -0.3010 -1.6890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3960 1.0430 -2.3060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1640 1.0060 -3.6570 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5760 0.5800 -3.1870 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3330 -0.3610 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 0.7490 0.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4880 0.5280 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 0.5370 1.9800 N 0 0 3 0 0 0 0 0 0 0 0 0 2.7290 1.3300 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 0.8660 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 2.2860 -4.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 2.2750 -5.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 3.5730 -6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 1.2240 -6.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 1.8480 -2.6040 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4210 2.3670 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 3.1750 0.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 2.8580 -3.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 3.7120 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 1.0730 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 3.4360 -1.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -0.0500 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -0.3740 3.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -0.1270 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -0.4460 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 2.0810 -1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 3.3370 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -1.8150 0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -3.1320 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -1.1160 -2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 0.1020 -3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 1.9370 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.5020 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -3.1650 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -1.5260 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -2.4310 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -2.0750 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 0.2340 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -0.0160 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -1.3810 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 0.7450 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 1.5370 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 0.1120 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 1.2010 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 2.3820 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 1.4580 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 0.9950 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -0.1860 4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 3.9240 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 3.4150 -7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 4.3170 -5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 1.5760 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 3.4590 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 1.9610 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.9470 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 4.4520 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 4.2200 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 3.1160 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 3.6440 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 1.0080 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -0.6470 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 0.9300 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -0.7260 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -0.3980 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 3.2240 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 4.0730 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 3.6720 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -3.1020 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -3.7860 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.5140 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 35 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 26 1 0 0 0 0 3 11 1 0 0 0 0 3 25 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 16 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 40 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 17 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 27 28 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 30 68 1 0 0 0 0 31 32 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 33 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 35 36 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 36 76 1 0 0 0 0 37 38 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 38 79 1 0 0 0 0 M END > 338 $$$$ 339 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 107111 0 0 1 0 0 0 0 0999 V2000 1.0100 -0.9170 0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -3.1630 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -2.2140 -2.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -4.4590 -1.4630 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9880 -4.6010 -0.0290 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4360 -3.2510 0.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5340 -2.1910 0.3210 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9950 -2.1320 -1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -3.3520 -1.5060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0920 -5.6940 -1.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -5.5810 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -3.3530 1.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 0.1190 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 1.4520 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 2.3980 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -0.0750 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 1.0120 0.4250 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6900 2.3210 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 3.4150 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 3.2630 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 1.0910 -0.9760 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4080 2.4210 -1.3350 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4580 -0.1780 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -0.0800 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 1.1830 -3.1920 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6920 2.2810 -2.1150 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0540 3.5170 -2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 1.4080 -3.9420 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0620 2.9540 -3.9980 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2350 1.1120 -7.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 0.9390 -6.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8290 0.8440 -5.3600 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2620 1.7860 0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 3.8100 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 1.9620 3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 0.6990 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 0.9280 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 2.9830 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 1.9970 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 1.4560 -4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -0.9820 -0.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7740 0.9650 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 -0.6200 -5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 1.5960 -6.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6990 1.1800 -7.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 1.3560 -9.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2280 1.2990 -9.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9780 0.2360 -10.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3890 3.3640 -3.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 2.6400 -9.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 0.8760 -5.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 2.9510 -11.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6290 2.1760 -11.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6050 4.2680 -11.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -2.7990 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -4.1170 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -2.0440 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -4.2000 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -4.9080 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -2.9680 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -2.4540 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -3.6300 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -6.4410 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -5.7230 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -2.5320 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -1.0800 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 4.4020 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 4.2440 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 2.7700 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 -0.6270 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -0.8560 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 3.9220 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 4.2750 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 3.3060 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7480 0.2670 -8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 2.0350 -7.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 3.8090 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 4.5040 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 4.1210 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 0.9480 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 2.6400 3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 1.9890 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 1.8650 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 0.6650 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.1380 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6910 1.0640 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 1.9120 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 2.8130 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 1.6990 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 2.2950 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 0.5710 -4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -0.6790 -4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -1.0590 -6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 -1.1680 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 2.5080 -6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1860 2.0260 -7.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2060 0.2570 -7.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6560 0.3340 -9.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2770 1.4240 -11.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7910 2.0970 -9.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9380 0.2770 -9.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0270 0.3610 -11.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4060 -0.7280 -9.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 4.3230 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2540 4.8280 -10.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3740 4.8420 -12.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 4.0850 -12.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 55 1 0 0 0 0 2 56 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 58 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 59 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 60 1 0 0 0 0 7 8 1 0 0 0 0 7 61 1 0 0 0 0 8 9 1 0 0 0 0 9 62 1 0 0 0 0 10 63 1 0 0 0 0 11 64 1 0 0 0 0 12 65 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 1 0 0 0 0 14 33 2 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 66 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 67 1 0 0 0 0 20 22 1 0 0 0 0 20 68 1 0 0 0 0 20 69 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 22 26 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 41 2 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 27 29 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 28 42 1 0 0 0 0 29 49 1 0 0 0 0 29 74 1 0 0 0 0 30 31 1 0 0 0 0 30 45 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 32 1 0 0 0 0 31 51 2 0 0 0 0 32 43 1 0 0 0 0 32 44 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 39 88 1 0 0 0 0 40 89 1 0 0 0 0 40 90 1 0 0 0 0 40 91 1 0 0 0 0 43 92 1 0 0 0 0 43 93 1 0 0 0 0 43 94 1 0 0 0 0 44 95 1 0 0 0 0 45 46 1 0 0 0 0 45 96 1 0 0 0 0 45 97 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 50 1 0 0 0 0 47 98 1 0 0 0 0 47 99 1 0 0 0 0 47100 1 0 0 0 0 48101 1 0 0 0 0 48102 1 0 0 0 0 48103 1 0 0 0 0 49104 1 0 0 0 0 50 52 1 0 0 0 0 52 53 2 0 0 0 0 52 54 1 0 0 0 0 54105 1 0 0 0 0 54106 1 0 0 0 0 54107 1 0 0 0 0 M END > 339 $$$$ 340 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 45 0 0 1 0 0 0 0 0999 V2000 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.4280 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.1110 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 1.3760 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.9800 -0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.1780 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.5550 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.7290 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -5.1600 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -5.8550 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.3160 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -7.9990 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -9.5060 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -10.0340 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -11.5640 1.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6910 -12.0900 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -13.6140 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -14.1400 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -12.0510 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 -13.2220 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -13.7900 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -13.8210 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9550 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.1910 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 1.4250 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 0.3330 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 1.5560 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -5.6880 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -5.3270 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -7.8430 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -7.4720 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -9.8700 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -9.8560 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -9.6700 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -9.6840 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -11.9130 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -11.6540 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -11.8160 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -14.0500 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -13.8880 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -13.8660 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -15.2260 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -13.7040 4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 -13.1160 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -13.9030 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -14.7640 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 3 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 3 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 M END > 340 $$$$ 341 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 47 51 0 0 1 0 0 0 0 0999 V2000 -0.1530 1.4630 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 1.9400 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 0.7920 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 4.5690 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 3.4020 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 2.1780 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 4.5170 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 3.2730 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 2.0820 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 0.8940 -0.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 3.1780 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -0.0040 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.3970 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -1.7390 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.9170 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -2.2970 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -2.6990 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -4.1560 -0.0070 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3490 -5.0020 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -4.5880 0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -3.2720 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.5470 0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -6.0000 -0.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -4.4630 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -4.4500 -1.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -5.9410 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -4.2300 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -4.6160 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -3.7220 -2.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8520 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 1.7880 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 5.5270 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 3.4690 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 1.2830 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 5.4280 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 4.0640 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -2.0510 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -2.9200 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -3.3360 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -3.8460 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -4.2460 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -6.5570 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -6.1810 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -6.1370 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -5.0560 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -5.3420 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -3.7290 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 10 2 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 9 2 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 14 17 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END > 341 $$$$ 342 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5190 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.6200 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 0.0270 -0.8920 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2200 1.5320 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 2.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 3.6290 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 2.5850 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 1.8470 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 3.9280 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 3.1870 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 2.1290 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 1.9400 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 3.3280 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 4.3520 -3.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 3.9810 -4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 0.8560 -3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -0.5460 -1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -0.5970 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -0.1780 -0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -1.1780 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.3580 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.3680 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -1.6900 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.5780 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.1480 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 1.9890 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 1.7090 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 3.2080 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.9240 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 2.3410 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 4.7440 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.2620 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 1.9850 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 4.0730 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 3.6010 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 4.0760 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 2.9490 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 4.6360 -5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 1.1410 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 -0.3880 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -1.6250 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 -1.9420 -3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 12 2 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END > 342 $$$$ 343 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5410 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5060 -0.3590 -0.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1630 0.7950 0.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 1.9370 -0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6780 2.0390 -1.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -0.5070 -1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 3.1730 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 3.5470 0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -1.5450 0.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -7.9770 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -7.6730 4.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -8.1890 5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -8.8740 6.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -7.9460 6.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -8.4620 8.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -9.1460 8.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -8.1900 9.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -7.3090 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -5.5470 0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -4.7710 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -3.4570 -0.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -5.0320 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -3.6340 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -2.8520 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -1.5540 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.7800 2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -5.8530 2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.9110 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -0.3970 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.5250 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 2.1230 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 3.0040 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -0.2620 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 3.9950 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 2.9460 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 4.3250 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 -7.6010 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -9.0560 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -7.3980 6.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -8.9640 9.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -8.1910 10.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -7.2180 9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -7.6090 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -7.6170 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -5.2320 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.6730 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -5.4650 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 8 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 28 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 25 2 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 28 48 1 0 0 0 0 M END > 343 $$$$ 344 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 26 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -0.4080 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 1.8470 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 0.6750 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 0.8050 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 2.0100 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 3.1170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 3.0810 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8120 -0.3970 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -1.4980 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 -0.2610 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -1.3340 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 4.0710 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 3.9970 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 0.2790 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 -1.2520 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 0.2880 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 6 2 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M END > 344 $$$$ 345 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 -0.0230 1.4650 0.0020 N 0 0 3 0 0 0 0 0 0 0 0 0 -0.0070 -0.0010 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -0.5760 1.1000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.0050 0.0070 1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 1.4740 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 1.9900 -0.0010 N 0 0 3 0 0 0 0 0 0 0 0 0 3.1200 -0.7480 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -0.2180 1.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -2.2510 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 3.2940 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 3.8950 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 3.2340 -2.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 5.3940 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8260 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.4680 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 1.8670 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 1.7790 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.5400 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -2.6540 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -2.6460 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 5.8150 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 5.8020 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 5.6500 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 M END > 345 $$$$ 346 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 0.7060 6.1550 0.7530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6030 4.8560 1.5510 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1340 3.6990 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 6.4150 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 5.2360 -0.4120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6100 3.9530 0.3950 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1520 2.8060 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 2.6550 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 5.1380 -1.8520 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1520 3.7590 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 6.0330 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 6.0460 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 4.9680 -4.4890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4690 3.6200 -3.7310 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1180 2.6670 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 3.0980 -6.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 4.5940 -5.8840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0290 2.0720 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 4.0300 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 5.5230 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 4.9650 2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 7.2400 1.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 3.2280 -3.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 5.3870 -4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 4.8050 -6.0340 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 4.5050 -7.4750 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2030 3.8680 -5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 6.1610 -5.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 4.5910 -7.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 3.2170 -7.3090 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5520 3.3000 -7.2880 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9990 2.3960 -8.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 1.5490 -8.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 2.2430 -8.4730 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0720 2.4300 -8.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 2.7920 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 1.2450 -8.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 5.4750 -8.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 5.0440 -9.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 3.8740 -9.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 6.0180 -10.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 6.1110 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 4.6650 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 2.7630 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 3.6500 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 7.3000 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 6.6420 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.6810 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 5.5490 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 5.8900 -3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 7.0140 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 5.7040 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 7.0700 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 2.7810 -4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 1.6310 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 2.9780 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 2.5020 -6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 5.1930 -6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 5.6020 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 4.7110 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 6.4600 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 5.6800 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 7.1570 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 2.3910 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 5.6720 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 4.5530 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 6.2340 -5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 3.5030 -7.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 4.2300 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 3.8390 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 2.8650 -5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 6.8120 -6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 5.3150 -6.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 4.9060 -8.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 2.8170 -6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 4.3240 -7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 2.7940 -9.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 3.4020 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 2.8570 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 1.7540 -5.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 0.5750 -8.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 1.7860 -7.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 0.6640 -7.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 6.9990 -10.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 5.6720 -10.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 6.0860 -11.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 8 10 2 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 49 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 25 1 0 0 0 0 17 58 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 22 63 1 0 0 0 0 23 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 26 38 1 0 0 0 0 26 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 30 75 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 31 76 1 0 0 0 0 32 33 1 0 0 0 0 32 35 2 0 0 0 0 33 34 1 0 0 0 0 34 37 1 0 0 0 0 34 77 1 0 0 0 0 36 78 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 37 83 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 84 1 0 0 0 0 41 85 1 0 0 0 0 41 86 1 0 0 0 0 M END > 346 $$$$ 347 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7850 -0.4890 -1.2210 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1060 0.0540 -1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 1.4820 -1.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4220 2.0470 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6850 1.9900 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.5000 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 3.4740 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.9480 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 1.5180 -2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.9160 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -2.4800 -2.3650 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7840 -3.9400 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -4.6160 -2.0260 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6010 -3.9920 -2.1910 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5260 -2.8420 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.2070 -3.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -6.0710 -2.5180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4010 -5.9400 -3.6910 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1670 -4.6230 -3.4740 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4950 -3.6860 -4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -4.4700 -5.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -4.2230 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -4.5780 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -6.8750 -1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -5.9020 -3.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -3.7940 -6.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -4.5400 -8.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -2.5860 -6.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.3670 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.1600 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 1.8370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.7260 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 1.6930 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -1.4640 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 3.9000 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.0360 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 1.5200 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.7790 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -2.0430 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -4.3880 -3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -2.4220 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -6.4940 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -6.2580 -4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -3.0930 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -3.0220 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -6.9460 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -5.2010 -8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -3.8280 -8.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -5.1300 -7.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 34 1 0 0 0 0 6 9 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 25 1 0 0 0 0 16 21 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 28 1 0 0 0 0 26 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END > 347 $$$$ 348 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 0.0350 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6570 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.4140 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.1000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 3.4300 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 3.5690 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 2.3160 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -2.1250 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -2.6740 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -0.6080 0.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0220 -2.2600 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -1.7520 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -0.9120 1.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8620 -1.8180 -0.4860 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9810 -2.9710 -0.6630 N 0 0 3 0 0 0 0 0 0 0 0 0 -1.7590 -3.8580 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -2.8820 -2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -1.5200 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -1.9490 2.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -2.7710 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -1.6690 2.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -1.5740 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.8810 4.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -2.3320 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 0.1840 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9420 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -0.5020 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 3.7120 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 4.3980 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -2.3110 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.6540 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -1.9530 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -3.5900 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -2.8960 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 0.0090 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -4.5710 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.3790 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -2.8120 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -3.2060 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -1.1730 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.7840 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -2.3290 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -3.7660 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -2.8460 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.8960 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -1.6280 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -3.0180 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 4 1 0 0 0 0 2 5 2 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 17 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 23 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END > 348 $$$$ 349 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 92 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3260 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.0140 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -0.4630 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 0.5660 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 1.7670 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -1.6170 -0.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 12.1890 -1.7720 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8000 12.3730 -1.9690 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1630 12.7480 -0.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4860 11.6630 0.4030 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9040 11.5220 0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 11.1250 -0.6970 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9020 11.7680 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 12.8540 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 13.7200 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 13.8830 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 14.3690 0.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 10.4220 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 4.0690 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 2.9940 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 2.2080 0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0180 4.0710 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 8.6120 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 9.3660 0.9320 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1120 8.3930 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 8.0030 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 7.0280 -0.8750 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1420 7.7880 -0.5950 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3300 6.8300 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 5.7510 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 5.8630 0.0870 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1050 4.9630 0.2070 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2080 3.1440 -1.1930 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4860 3.9720 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 5.0760 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 2.3260 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 4.0850 -1.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 6.3110 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 8.5860 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 6.5570 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 12.9640 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 10.9780 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 13.4160 -2.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.6040 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 2.4930 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 2.1980 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 13.1330 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 11.4430 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 13.7040 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 11.9460 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 10.1720 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 11.6310 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 14.6650 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 14.1590 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 12.9440 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 4.7130 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 3.6100 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 2.2730 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 3.4040 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 1.5680 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 7.8310 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 9.3120 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 9.7830 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 8.9260 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 7.6010 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 7.4830 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 8.8010 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 6.3840 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 7.3940 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 5.0540 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 6.2030 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 4.3740 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 3.2810 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 4.6830 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 5.7880 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.7310 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 1.6650 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 3.0020 -3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 7.4160 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 5.8600 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 6.0590 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 13.8140 -4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 12.2490 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 12.4830 -4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 10.6770 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 10.2210 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 11.9320 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 12 42 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 33 1 0 0 0 0 21 60 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 22 37 2 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 28 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 28 39 1 0 0 0 0 29 30 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 30 32 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 31 38 1 0 0 0 0 33 34 1 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 41 43 1 0 0 0 0 41 82 1 0 0 0 0 41 83 1 0 0 0 0 41 84 1 0 0 0 0 42 85 1 0 0 0 0 42 86 1 0 0 0 0 42 87 1 0 0 0 0 M END > 349 $$$$ 350 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 74 77 0 0 1 0 0 0 0 0999 V2000 0.0970 1.3520 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 2.0000 0.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2910 -0.0420 -0.8610 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1270 1.4820 -0.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5140 2.0750 -1.1220 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0690 1.5670 -2.4800 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3470 0.0840 -2.3300 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9960 -0.6120 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 2.4650 -2.7230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9410 3.8030 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 3.5950 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 1.7900 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 1.7580 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -0.1390 -1.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.1670 0.5770 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9130 -0.6860 -0.7030 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0680 -2.2060 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -2.5600 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -2.0400 1.8680 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1310 -0.5210 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.3280 -1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 1.6700 1.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -0.2760 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -2.3750 3.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -3.5520 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -4.2790 3.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -3.9670 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -0.6280 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 1.7310 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 2.6910 -4.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5960 3.7100 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 4.0300 -5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 5.0340 -6.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 5.4650 -7.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 5.4510 -5.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 1.3680 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 2.0220 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 1.7220 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.6040 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.0830 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -0.3020 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -1.6780 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.4710 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 4.0430 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 4.6040 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 3.9360 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 4.1060 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 2.8440 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 1.4950 -4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 1.1900 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -1.0690 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.6650 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -2.5770 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -3.6420 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -2.1000 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -2.5000 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -0.0600 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.1500 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.6960 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.7870 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.7550 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 1.9680 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -3.6130 5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -5.0540 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -3.5350 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 3.0680 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 4.6230 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 3.2960 -4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 3.1170 -6.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 4.4440 -6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8130 6.1090 -7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 0.6200 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 1.5130 -5.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 1.0280 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 16 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 22 62 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 30 31 1 0 0 0 0 30 36 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 71 1 0 0 0 0 36 72 1 0 0 0 0 36 73 1 0 0 0 0 36 74 1 0 0 0 0 M END > 350 $$$$ 351 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 26 25 0 0 0 0 0 0 0 0999 V2000 0.1510 1.3910 -0.0320 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3020 -0.0010 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.8490 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.4420 2.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -1.0920 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 1.4320 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 2.1810 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.9500 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -0.7240 4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -1.9720 3.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -0.0410 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.3900 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.9000 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -0.7060 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 1.0170 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 2.4650 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.8460 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 2.1500 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 3.2140 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.7660 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 1.4780 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 3.0240 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 1.7640 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 0.0840 4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -1.5930 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.3990 5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 M CHG 1 1 1 M END > 351 $$$$ 352 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 103110 0 0 1 0 0 0 0 0999 V2000 -2.1160 0.1630 0.2760 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7820 -1.3320 0.2510 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9770 -1.6460 -1.0120 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2050 -0.8430 -1.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.5640 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 0.9670 0.2020 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6140 -3.0280 -1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -2.0910 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 0.4790 1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 2.3620 0.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -9.0480 -6.8990 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9700 -9.4490 -7.5400 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8280 -8.1680 -7.5740 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8100 -7.5830 -6.5090 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3530 -7.4190 -6.3440 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5860 -5.9180 -6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -5.4350 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -7.0950 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -6.0280 -4.4340 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2910 -7.0190 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -7.5470 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -5.4880 -3.6620 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9220 -5.1720 -3.5720 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2780 -3.7130 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -3.2670 -2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.4530 -2.2090 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3310 -4.8950 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -4.9630 -2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -5.7320 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -6.2510 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -8.0940 -5.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -6.7040 -7.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -9.1850 -7.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 -8.3880 -7.7450 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7960 -9.7830 -7.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -8.0600 -9.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -10.8420 -7.5830 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0800 -10.7980 -8.9900 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7170 -12.2100 -9.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -12.1450 -10.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 -13.0730 -9.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -12.7930 -8.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -9.9930 -8.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -10.4350 -6.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -5.0820 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -14.0390 -8.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -14.7100 -7.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -14.6230 -9.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -7.5940 -8.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 0.4100 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.5880 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -1.4270 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 1.1020 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.8120 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 0.7570 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8570 -3.0480 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 1.4120 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 2.9320 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -9.6550 -6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -5.7010 -6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -5.4290 -7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -5.7000 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -4.3490 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -7.2960 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -7.4350 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -8.3100 -5.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -3.6170 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -3.0980 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -3.8640 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -2.2150 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -2.8320 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -6.0020 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -4.5380 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -4.3960 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -5.7190 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -5.3150 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -6.7590 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -7.1490 -2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -5.9210 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -8.0900 -5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -7.5500 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -9.1220 -5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -6.9910 -7.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -5.6590 -7.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -6.8340 -8.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -10.0890 -8.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 -7.6840 -7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 -10.0200 -8.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 -9.8030 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -6.9930 -9.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 -8.3270 -9.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -8.6260 -9.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -11.8360 -7.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -10.3340 -9.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -11.7070 -11.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -13.1510 -11.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -11.5300 -10.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -13.1200 -8.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 -14.0790 -9.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -12.6350 -10.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -14.4890 -8.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -15.7870 -7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -14.3370 -6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 53 1 0 0 0 0 5 54 1 0 0 0 0 6 10 1 0 0 0 0 6 55 1 0 0 0 0 7 26 1 0 0 0 0 8 56 1 0 0 0 0 9 57 1 0 0 0 0 10 58 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 60 1 0 0 0 0 16 61 1 0 0 0 0 17 19 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 23 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 21 66 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 26 27 1 0 0 0 0 26 71 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 29 77 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 32 85 1 0 0 0 0 33 86 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 87 1 0 0 0 0 35 37 1 0 0 0 0 35 88 1 0 0 0 0 35 89 1 0 0 0 0 36 90 1 0 0 0 0 36 91 1 0 0 0 0 36 92 1 0 0 0 0 37 38 1 0 0 0 0 37 44 1 0 0 0 0 37 93 1 0 0 0 0 38 39 1 0 0 0 0 38 43 1 0 0 0 0 38 94 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 41 98 1 0 0 0 0 41 99 1 0 0 0 0 41100 1 0 0 0 0 42 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 2 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 M END > 352 $$$$ 353 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 94 0 0 1 0 0 0 0 0999 V2000 -0.6650 1.5560 0.1520 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4100 0.0470 0.0290 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0870 -0.1060 -0.2980 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7180 2.2040 0.0310 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7120 1.0770 0.4250 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0580 1.5380 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 2.7100 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 3.4240 0.8760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4410 3.7940 0.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5200 5.9100 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 4.5690 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 6.2890 0.3130 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8860 5.2300 0.7300 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3080 5.5060 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 6.8980 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 7.9440 0.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3340 7.6510 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 9.2390 0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 8.7350 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 7.6290 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 4.7170 2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 0.8540 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 2.5770 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 2.0030 -0.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -1.4580 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0 0 0 0 4.3800 3.1670 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 6.6690 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 5.8130 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 4.6180 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 4.3760 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 4.7560 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 5.4800 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 6.9020 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 7.1390 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 7.9220 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 9.4990 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 8.5210 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 9.7060 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 8.7520 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 6.8590 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 8.6010 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 7.4120 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 5.0800 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 4.5260 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -0.0220 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 1.7300 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 0.6960 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 3.1700 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 3.1580 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 1.6690 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 1.5920 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.3310 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -3.3870 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.2690 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -1.6670 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -3.2060 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -2.1540 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -2.6330 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.6380 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -3.1750 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -2.8680 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.5030 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -3.9150 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -4.2760 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -4.5830 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -0.2640 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -1.6580 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -0.6060 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 9 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 36 1 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 24 71 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 72 1 0 0 0 0 26 28 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 27 75 1 0 0 0 0 27 76 1 0 0 0 0 27 77 1 0 0 0 0 28 29 1 0 0 0 0 28 35 1 0 0 0 0 28 78 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 29 79 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 32 85 1 0 0 0 0 33 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 39 88 1 0 0 0 0 M END > 353 $$$$ 354 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 105112 0 0 1 0 0 0 0 0999 V2000 -2.2600 0.1790 -0.2780 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9380 -1.3190 -0.2710 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0550 -1.6490 -1.4780 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1320 -0.8550 -1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 0.5530 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 0.9720 -0.2740 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7040 -3.0340 -1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -2.0690 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 0.5090 0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 2.3690 -0.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -8.5460 -7.6550 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3080 -8.7130 -8.3960 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1210 -7.4390 -8.1030 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1240 -7.2490 -6.8540 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6590 -7.0600 -6.7040 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8380 -5.5960 -6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -5.4410 -4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -7.2190 -5.5000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9480 -6.0520 -4.6410 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2260 -6.8820 -4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -7.2240 -5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -5.3880 -4.1300 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9440 -5.1680 -3.9160 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3210 -3.7220 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.3010 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.4740 -2.5930 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2980 -4.9440 -2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 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0 0 0 0 0 0 0 0 3.3890 -3.6610 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -3.0690 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -3.9200 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -2.2560 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.8720 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -6.1500 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -4.7870 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -4.4900 -3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -5.6800 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -5.4810 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -6.8470 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -7.1420 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -5.9480 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -7.9280 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -7.7160 -4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -9.0250 -5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -6.3330 -8.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -5.1860 -7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -5.9290 -8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -9.2060 -9.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 -7.0140 -7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 -8.9760 -9.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -9.2250 -7.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -5.7720 -9.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -7.0130 -9.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 -7.2390 -10.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 -10.9870 -8.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -8.9360 -10.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 -9.8150 -12.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -11.3400 -12.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -9.8950 -12.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 -11.9100 -10.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -12.5170 -11.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -10.9910 -11.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -13.3340 -9.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -13.8930 -10.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -14.7310 -9.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 54 1 0 0 0 0 5 55 1 0 0 0 0 6 10 1 0 0 0 0 6 56 1 0 0 0 0 7 26 1 0 0 0 0 8 57 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 60 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 61 1 0 0 0 0 16 62 1 0 0 0 0 17 19 1 0 0 0 0 17 63 1 0 0 0 0 17 64 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 45 1 0 0 0 0 19 23 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 65 1 0 0 0 0 20 66 1 0 0 0 0 21 67 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 69 1 0 0 0 0 24 70 1 0 0 0 0 25 26 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 26 27 1 0 0 0 0 26 73 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 28 76 1 0 0 0 0 29 77 1 0 0 0 0 29 78 1 0 0 0 0 29 79 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 31 82 1 0 0 0 0 31 83 1 0 0 0 0 31 84 1 0 0 0 0 32 85 1 0 0 0 0 32 86 1 0 0 0 0 32 87 1 0 0 0 0 33 88 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 89 1 0 0 0 0 35 37 1 0 0 0 0 35 90 1 0 0 0 0 35 91 1 0 0 0 0 36 92 1 0 0 0 0 36 93 1 0 0 0 0 36 94 1 0 0 0 0 37 38 1 0 0 0 0 37 44 1 0 0 0 0 37 95 1 0 0 0 0 38 39 1 0 0 0 0 38 43 1 0 0 0 0 38 96 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 40 97 1 0 0 0 0 40 98 1 0 0 0 0 40 99 1 0 0 0 0 41100 1 0 0 0 0 41101 1 0 0 0 0 41102 1 0 0 0 0 42 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 2 0 0 0 0 48103 1 0 0 0 0 48104 1 0 0 0 0 48105 1 0 0 0 0 M END > 354 $$$$ ATCMD MOE2008 3D 77 80 0 0 1 0 0 0 0 0999 V2000 5.4600 -0.5400 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 0.0510 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 -0.5510 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 1.4200 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 1.8700 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 2.2060 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 3.2690 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 1.6240 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 2.2350 -3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 0.2550 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -0.1840 -4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -0.7390 0.4090 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9900 -0.4110 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 2.5970 0.4260 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2760 2.4320 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.5380 0.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9520 0.1610 -0.3760 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2570 -0.5840 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -0.2670 -0.4110 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6380 -0.5770 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 1.2400 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 1.5200 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.4700 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 2.1360 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 2.3300 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.1080 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 2.7400 -0.7260 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2110 3.1670 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -0.7670 -0.0900 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5310 1.4930 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 0.6260 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 1.0350 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -1.4010 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -1.9530 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -2.1420 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -0.4220 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -1.3640 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -1.8480 -2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.5380 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 1.7830 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 1.5510 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 1.5130 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 2.8670 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.3430 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 0.5210 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 1.1390 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 2.2500 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 1.1480 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 2.2030 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 1.0090 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 0.6000 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 0.5200 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 0.1630 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2330 1.5030 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -0.1600 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.9280 -1.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 0.4810 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 3.9160 0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 4.5180 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -0.8320 -3.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -2.1030 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -2.6540 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -3.7350 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -1.9770 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -2.5220 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -2.7050 0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 3.7580 -0.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 3.7910 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -2.1040 0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -1.6310 0.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -1.7770 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -2.8680 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -4.1760 1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -4.7590 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -4.7360 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.0020 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -2.5380 2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 64 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 12 69 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 14 58 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 37 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 56 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 67 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 48 1 0 0 0 0 31 52 1 0 0 0 0 32 36 1 0 0 0 0 32 40 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 36 60 2 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 56 61 1 0 0 0 0 58 59 1 0 0 0 0 61 62 1 0 0 0 0 61 66 2 0 0 0 0 62 63 1 0 0 0 0 62 64 2 0 0 0 0 64 65 1 0 0 0 0 67 68 1 0 0 0 0 69 72 1 0 0 0 0 70 71 1 0 0 0 0 72 73 1 0 0 0 0 72 77 2 0 0 0 0 73 74 1 0 0 0 0 73 75 1 0 0 0 0 73 76 1 0 0 0 0 M END > 355 $$$$ 356 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0850 1.3410 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.0880 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 3.4160 0.1420 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7110 3.9430 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 3.4420 -1.2590 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3650 1.9130 -1.2990 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9860 1.5460 -1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 1.8900 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8360 3.7680 1.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 3.8150 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 1.4220 -2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -0.0030 -2.6050 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8560 -0.5170 -1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -0.2590 -1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 0.0310 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -0.4130 -3.9870 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9030 0.1140 -4.2050 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5160 -0.8610 -5.2340 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7100 -2.1680 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -1.9470 -4.0500 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4080 -0.3150 -6.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 1.4530 -4.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -0.0530 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.5810 -4.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -2.4870 -2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -3.9120 -4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -4.6390 -4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -4.5280 -4.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 4.7340 0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.6990 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.6810 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5050 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 3.8400 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 3.8680 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 1.4840 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 1.4610 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 4.7210 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 4.7700 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -0.4070 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -0.2940 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7560 0.2210 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 -1.0490 -4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -2.3830 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -2.9910 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -0.8820 -7.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 1.8160 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -2.0450 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -2.2310 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -3.5710 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -4.2570 -5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -5.7050 -5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.4800 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 29 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 24 1 0 0 0 0 20 25 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END > 356 $$$$ 357 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 0.8650 1.9800 -1.0570 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9470 0.5540 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.0590 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 1.1120 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 2.4100 -0.7350 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1430 5.7080 -3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 4.5630 -3.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 3.5890 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 5.1730 -2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 5.4220 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 2.8080 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 3.5110 0.3110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7150 4.8410 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 6.3140 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 3.5350 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 3.3400 -1.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -1.1260 -0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 0.9600 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 3.1880 1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 3.7070 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 3.5390 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 2.7230 3.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0130 1.2460 3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 4.3140 2.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 4.1070 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 3.1610 2.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 0.4540 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -0.8730 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -1.7590 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -1.3570 2.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 2.1120 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 2.7500 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 6.0930 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 6.5070 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 4.9540 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 4.0690 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 4.5710 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 2.7580 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 3.5980 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 4.6730 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 5.5430 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 5.9320 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 6.3300 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 7.3250 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 2.7090 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 4.4720 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 3.2950 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -0.0260 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 1.8210 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 2.8530 4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 0.9230 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 1.1100 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 3.9830 5.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 4.6910 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 3.0740 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 -1.1480 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 -2.4780 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 -2.2910 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 17 2 0 0 0 0 4 5 1 0 0 0 0 4 18 2 0 0 0 0 5 12 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 11 2 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 50 1 0 0 0 0 23 27 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END > 357 $$$$ 358 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5310 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -0.4830 -1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 1.9790 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 1.5420 -1.2530 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6280 0.2880 -1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -0.1370 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 0.6860 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 2.5920 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 2.1430 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 3.0200 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 4.3620 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 4.7960 -3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 3.9070 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 0.2070 -3.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 5.3350 -5.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3850 5.9810 -6.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 6.1050 -3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.9680 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -0.3500 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -1.2130 -3.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 1.1420 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 2.5750 -5.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 6.8290 -7.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 7.4730 -7.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 8.3710 -8.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 7.3320 -7.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 4.4080 -1.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 6.4200 -4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.9180 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.8890 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.3680 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.3860 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 3.0280 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 1.4610 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 4.8070 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 5.2020 -6.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 6.5820 -5.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 6.3170 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.5310 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -2.3500 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.0780 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 0.6940 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.6900 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.9580 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -1.3780 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 0.3410 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 0.7970 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 2.0040 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 2.2910 -6.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 8.3720 -9.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 8.0060 -9.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 9.3850 -8.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 4.3390 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 5.9610 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 7.1250 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 6.9490 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 36 1 0 0 0 0 17 24 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END > 358 $$$$ 359 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3990 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6960 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.1250 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 0.0430 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 2.2450 -0.0360 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8620 3.8390 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 2.8100 -1.3800 N 0 0 3 0 0 0 0 0 0 0 0 0 6.1160 3.2990 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 2.1690 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2950 1.7010 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 2.3310 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 3.4630 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 3.9410 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 1.4120 0.3380 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8350 0.1200 -0.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6710 -0.7470 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 1.8170 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 0.6720 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -0.4570 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 5.0450 -1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5360 4.2680 -0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 5.0230 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 1.0560 1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 3.3510 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 0.4390 -1.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 3.0660 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -0.4000 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 -1.3690 -2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -0.1340 -4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7760 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.2050 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 4.1550 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 4.6980 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 0.8180 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 1.9570 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -0.4150 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -1.0990 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -1.6040 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 0.6550 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.6760 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2910 4.5230 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 6.0360 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 0.4850 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 0.4590 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 1.9710 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 4.1370 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 3.7620 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 2.5540 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 0.7770 -4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -0.0130 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 -0.9720 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 6 2 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END > 359 $$$$ 360 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.9340 1.8210 -0.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8560 0.3020 -0.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3790 2.4000 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.2480 -1.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 2.1500 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.0260 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 3.6450 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 4.3110 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 4.2320 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -1.5020 -1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -2.1090 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -2.1110 -1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -3.4090 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -4.2570 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -5.1130 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -5.9050 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -5.8560 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -5.0070 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -4.2150 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -6.6390 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 1.8020 -2.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 2.7270 -2.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.5850 0.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 0.3040 1.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 2.2310 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.1230 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 3.6330 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 5.2230 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 4.5600 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -1.5330 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -3.8240 -4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -5.1520 -4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -6.5660 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -4.9720 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -3.5560 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -7.5080 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 2.0350 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 0.0730 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 25 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 2 26 1 0 0 0 0 3 7 1 0 0 0 0 4 10 1 0 0 0 0 5 21 1 0 0 0 0 5 22 2 0 0 0 0 6 23 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 13 2 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 24 38 1 0 0 0 0 M END > 360 $$$$ 361 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.5020 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0300 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5690 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0420 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.6160 -1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9770 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8650 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 5.4580 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9940 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.6080 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -2.0640 -5.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 -3.3440 -5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -4.3080 -4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -3.9080 -3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -5.7220 -5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -4.7240 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -1.5820 -4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -2.4560 -3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -1.9580 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -0.6080 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 0.2690 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -0.2120 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -6.4330 -5.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 -7.7480 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -8.3640 -6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -7.6600 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -6.3460 -5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -9.6600 -6.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9330 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 3.6390 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 4.0010 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 1.6100 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5450 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 4.8180 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8600 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7360 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -3.6280 -6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -2.6350 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -0.2180 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 0.4760 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -5.9540 -5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 -8.2990 -6.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -8.1420 -5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -5.7980 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -10.3000 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.5380 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -2.4830 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.4740 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 20 1 0 0 0 0 17 25 1 0 0 0 0 17 29 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END > 361 $$$$ 362 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 -0.6490 -1.1450 1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.0360 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 0.8930 1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 0.5450 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -1.6690 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -1.2740 5.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -2.1360 5.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -3.3910 5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -3.7900 4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -2.9370 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -0.7490 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -1.1340 2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 0.3550 4.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -4.8920 2.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -0.1650 2.2460 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4100 0.3420 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -0.1080 2.5130 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3050 -0.8580 2.1330 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7440 -2.2400 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -0.8440 3.5210 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9060 1.3530 0.3620 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4160 0.3240 0.8850 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5690 0.8450 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 1.4400 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -0.2300 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.8160 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -0.8220 -1.2590 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8060 -0.8600 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 1.9740 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 2.6100 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -0.9800 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 2.6810 0.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5460 -0.1060 1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -0.8900 4.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -2.1870 -1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -3.0600 2.9810 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2140 -2.3170 2.5330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6660 -2.5240 3.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -3.2690 4.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -3.0870 1.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -4.3990 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -5.2580 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 1.1440 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -0.2920 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 1.2550 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 1.0390 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.2950 5.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -1.8320 6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -4.0630 5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 3.0020 -2.2840 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -4.0020 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -1.6060 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -3.1360 3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -4.6440 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -6.0430 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -5.7100 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.9590 2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 0.9480 3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 1.4240 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 22 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 8 9 2 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 15 1 0 0 0 0 14 41 2 0 0 0 0 15 18 1 0 0 0 0 15 22 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 33 2 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 43 1 0 0 0 0 18 31 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 34 1 0 0 0 0 20 55 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 21 56 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 29 1 0 0 0 0 24 30 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 35 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 32 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 75 1 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 43 78 1 0 0 0 0 43 79 1 0 0 0 0 43 80 1 0 0 0 0 M END > 362 $$$$ 363 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 89 0 0 1 0 0 0 0 0999 V2000 -1.9440 1.4250 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 0.0480 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.5930 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 0.1500 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 1.5390 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 2.1680 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 3.0890 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 2.3080 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -0.5440 0.5520 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4130 -0.9170 -0.8850 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0780 1.7370 -0.7800 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3000 0.3140 1.1520 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3250 1.6940 0.5340 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0000 2.7060 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 2.6830 2.9270 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0320 1.2400 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 0.3450 2.6600 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3300 1.3500 -2.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3310 0.2650 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 0.4970 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 1.7620 -3.3570 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5780 2.5230 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -0.3890 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 3.6130 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 2.5470 -3.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 2.0220 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 3.0640 3.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 0.1910 0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -1.5080 -1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 -0.3710 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -1.0040 3.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 0.8460 -3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 2.0170 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 -0.1390 -2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 0.2270 -4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.5300 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -1.7380 0.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -1.3010 4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -2.6820 4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -0.4600 4.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 3.2470 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 4.5950 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 2.3270 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 3.1040 -4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 1.5050 -5.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 1.9220 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -0.5260 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.6680 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 2.1200 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 3.2420 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -1.4580 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -1.6490 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 1.0780 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 3.3610 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 0.9440 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 1.1650 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 0.7170 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 1.5250 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 3.2150 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 3.0380 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -0.0610 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -0.3280 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -1.4190 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 4.2140 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 3.7600 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 3.0700 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8270 -2.3080 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -0.3610 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 0.1610 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -1.4020 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 2.3680 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 1.6900 -4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 2.8280 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6710 0.1800 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 1.0100 -4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -0.2690 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -0.5020 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 -2.8950 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -2.7330 5.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -3.4150 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 5.1600 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4370 4.4610 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7960 5.1390 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 3.7920 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 3.6680 -5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.4140 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 46 1 0 0 0 0 2 3 2 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 48 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 50 1 0 0 0 0 7 11 1 0 0 0 0 7 41 1 0 0 0 0 8 41 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 9 51 1 0 0 0 0 10 19 1 0 0 0 0 10 29 1 0 0 0 0 10 52 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 24 2 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 31 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 43 1 0 0 0 0 27 66 1 0 0 0 0 28 36 1 0 0 0 0 29 67 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 31 38 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 74 1 0 0 0 0 35 75 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 36 37 2 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 78 1 0 0 0 0 39 79 1 0 0 0 0 39 80 1 0 0 0 0 41 42 1 0 0 0 0 42 81 1 0 0 0 0 42 82 1 0 0 0 0 42 83 1 0 0 0 0 43 44 1 0 0 0 0 43 45 2 0 0 0 0 44 84 1 0 0 0 0 44 85 1 0 0 0 0 44 86 1 0 0 0 0 M END > 363 $$$$ 364 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 69 73 0 0 1 0 0 0 0 0999 V2000 -0.2670 1.2810 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.6240 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 0.5330 0.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -0.5140 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -0.0970 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 0.9660 -6.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 1.1350 -6.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 1.4070 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 1.4360 -5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 2.1920 -4.2930 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2700 1.5550 -3.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8820 2.2680 -2.7300 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9580 2.0970 -1.5160 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0040 2.1220 -3.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5800 2.6830 -1.8030 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7140 2.7460 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 2.5730 -3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 1.8680 -1.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6230 2.2800 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 2.2410 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 1.8580 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 2.1900 0.3190 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0560 0.3770 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 1.6860 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 0.7090 -1.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1400 2.6300 -5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 0.1810 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 1.0570 -7.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1150 3.6260 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 4.2150 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0810 2.5020 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8110 3.6630 -1.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4390 1.9700 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.6100 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -1.5190 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -0.7000 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 0.4530 -7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 1.2870 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 0.5200 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0200 3.3280 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 2.6200 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 1.0190 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 2.4750 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 3.7920 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 1.8340 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 3.5220 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 2.4530 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 2.4630 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 0.7990 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 3.2360 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 0.1280 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -0.2070 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 0.1480 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 0.2840 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 2.4360 -6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6640 2.8250 -4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 3.4970 -5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -0.7170 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 0.3260 -3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8450 0.0690 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 3.6210 -5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 4.1770 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 4.1060 -4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 4.5630 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 4.6280 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 4.5430 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4110 1.6010 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1770 2.7680 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7110 1.1550 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 28 2 0 0 0 0 8 11 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 40 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 42 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 31 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 M END > 364 $$$$ ATCMD MOE2008 3D 99103 0 0 1 0 0 0 0 0999 V2000 6.7640 -0.0700 -1.8750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 -1.5850 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -1.9760 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -1.3850 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -3.1190 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -3.4070 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -3.8800 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -4.7610 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -3.5000 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -4.0790 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -2.3620 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -2.0760 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -1.3720 1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -0.0200 1.7310 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4200 -0.6540 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -0.9450 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -0.3560 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -1.1420 0.8630 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9470 -1.4090 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 2.2890 0.3250 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6150 1.9990 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.6510 1.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1860 0.1470 0.8520 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5860 0.9220 1.3920 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4500 0.7310 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 2.3540 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 2.5590 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 3.0640 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 2.6370 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 2.6300 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 3.6690 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 2.0200 -1.1860 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3610 2.1490 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -0.8670 0.1250 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9160 0.6460 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.5350 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 0.3830 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -1.7110 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -1.8770 1.4650 H 0 0 0 0 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0.6380 0.1590 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 3.0350 -1.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 3.2600 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 0.0090 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 3.7500 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -1.7300 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.2220 0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.5270 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -3.8560 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -4.9330 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -3.3530 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -3.6060 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -4.4070 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 -2.6550 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -3.4350 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -3.9380 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 -2.7660 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 -4.1940 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -2.8360 1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 1.1320 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 0.8560 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 0.6360 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 1.7910 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 1.6720 0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -0.3100 -2.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2500 -0.4580 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2400 1.2440 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 1.4120 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 1.3450 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 2.0520 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -1.1040 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -0.9490 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 -1.0950 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3570 -2.1090 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 4.4790 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 5.8910 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 5.9070 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 6.4350 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 6.3780 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 4.0420 0.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 1 84 1 0 0 0 0 1 86 1 0 0 0 0 1 90 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 2 84 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 34 1 0 0 0 0 18 66 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 20 64 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 22 47 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 59 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 32 61 1 0 0 0 0 34 36 1 0 0 0 0 34 38 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 51 1 0 0 0 0 36 55 1 0 0 0 0 37 41 1 0 0 0 0 37 43 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 41 42 1 0 0 0 0 41 65 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 59 79 1 0 0 0 0 61 62 1 0 0 0 0 64 94 1 0 0 0 0 65 73 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 67 72 2 0 0 0 0 68 69 1 0 0 0 0 68 70 1 0 0 0 0 68 71 1 0 0 0 0 73 74 1 0 0 0 0 73 78 2 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 74 77 1 0 0 0 0 79 80 1 0 0 0 0 79 83 2 0 0 0 0 80 81 1 0 0 0 0 80 82 1 0 0 0 0 80 84 1 0 0 0 0 84 85 1 0 0 0 0 86 87 1 0 0 0 0 86 88 1 0 0 0 0 86 89 1 0 0 0 0 90 91 1 0 0 0 0 90 92 1 0 0 0 0 90 93 1 0 0 0 0 94 95 1 0 0 0 0 94 99 2 0 0 0 0 95 96 1 0 0 0 0 95 97 1 0 0 0 0 95 98 1 0 0 0 0 M END > 365 $$$$ ATCMD MOE2008 3D 89 93 0 0 1 0 0 0 0 0999 V2000 5.2980 -0.6550 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 0.1300 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 1.1510 6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6610 -0.3850 6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 0.2320 7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 -1.6880 6.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8390 -2.0900 7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -2.4750 5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0770 -3.4880 5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -1.9600 4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -2.5900 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.4400 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -1.4780 0.7920 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4010 -1.3670 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.6200 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -1.5810 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -3.4720 -0.3440 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3760 -3.3440 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.4810 -3.3510 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7480 0.6050 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -0.6070 -1.6450 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8990 -2.0410 -0.5900 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7330 -0.5170 0.7990 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3710 0.4700 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -0.4140 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 0.3450 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -1.3520 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.1260 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 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-0.6440 -6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -0.5140 -5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -0.0650 -7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.6950 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 0.7320 -5.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -0.0490 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -0.7460 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -1.8100 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 1.1530 2.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -0.0600 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 1.0130 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -7.1500 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -7.3700 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -6.6950 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4030 -7.2570 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -8.3950 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 -8.0330 -5.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 0.5680 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 1.2510 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 0.2200 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 1.1970 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 78 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 17 61 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 19 57 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 21 86 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 52 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 29 54 1 0 0 0 0 31 33 1 0 0 0 0 31 35 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 44 1 0 0 0 0 33 48 1 0 0 0 0 34 38 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 38 39 1 0 0 0 0 38 60 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 74 1 0 0 0 0 54 55 1 0 0 0 0 57 68 1 0 0 0 0 60 80 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 62 67 2 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63 66 1 0 0 0 0 68 69 1 0 0 0 0 68 73 2 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 69 72 1 0 0 0 0 74 75 1 0 0 0 0 74 77 2 0 0 0 0 75 76 1 0 0 0 0 75 78 2 0 0 0 0 78 79 1 0 0 0 0 80 81 1 0 0 0 0 80 85 2 0 0 0 0 81 82 1 0 0 0 0 81 83 1 0 0 0 0 81 84 1 0 0 0 0 86 87 1 0 0 0 0 86 88 1 0 0 0 0 86 89 1 0 0 0 0 M END > 366 $$$$ 367 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 106111 0 0 1 0 0 0 0 0999 V2000 0.0050 1.1980 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.2440 0.9150 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4710 -1.1370 2.0340 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4690 -2.5730 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -3.1920 1.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.8120 1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 3.1340 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 3.8430 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 3.2300 1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 1.9090 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -4.8540 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -6.2840 -0.0590 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0290 -6.7460 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -5.4720 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -4.5850 0.8720 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1560 -3.2610 -2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 -3.8600 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5590 -5.1970 -4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -5.9420 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -5.3450 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -3.9950 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -6.1370 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -5.5570 -0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -7.3110 -1.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -7.0660 3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -7.5790 3.1970 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6830 -6.4090 0.5720 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0560 -8.3190 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -6.6860 -1.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -5.4240 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -6.9330 3.1150 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7290 -5.9210 2.0190 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6460 -4.7240 2.1640 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2290 -4.3770 3.5270 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8480 -5.3150 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -6.7460 4.1420 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0750 -3.5430 1.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -5.0040 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -4.5740 2.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -7.0820 3.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -2.4110 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -2.4010 2.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -1.1510 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -9.0080 3.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -9.7580 4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -11.2600 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -9.2300 4.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -6.7650 5.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -7.2240 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -3.1660 1.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -0.4260 -0.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.7420 2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -0.1250 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 0.2060 -1.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.1980 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -4.8960 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -7.1600 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -8.6580 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -0.5140 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -1.0360 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 1.2580 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 3.6130 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 4.8760 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 3.7840 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 1.4300 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -4.1730 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -4.6210 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -4.7040 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 -2.2180 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -3.2810 -4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0480 -5.6580 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -6.9860 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 -3.5270 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -7.3770 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -7.4130 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -8.8170 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -8.2290 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -8.9040 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -6.1460 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -3.3270 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 -5.2110 5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -5.0520 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -7.4330 4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -6.0520 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 -4.3470 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 -6.9860 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 -0.5960 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -0.5360 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -1.4110 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -11.5500 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -11.6980 4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -11.6190 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -0.7650 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -0.8780 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.7670 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -0.4530 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -0.9630 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -4.5000 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -4.0960 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -5.6800 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -6.1460 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -7.4350 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -7.8520 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -9.3050 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -8.9920 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -8.7030 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 10 2 0 0 0 0 2 3 1 0 0 0 0 2 51 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 52 1 0 0 0 0 3 60 1 0 0 0 0 4 5 1 0 0 0 0 4 50 2 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 61 1 0 0 0 0 7 8 1 0 0 0 0 7 62 1 0 0 0 0 8 9 2 0 0 0 0 8 63 1 0 0 0 0 9 10 1 0 0 0 0 9 64 1 0 0 0 0 10 65 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 66 1 0 0 0 0 11 67 1 0 0 0 0 12 27 1 0 0 0 0 12 29 1 0 0 0 0 12 49 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 56 1 0 0 0 0 15 68 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 69 1 0 0 0 0 17 18 2 0 0 0 0 17 70 1 0 0 0 0 18 19 1 0 0 0 0 18 71 1 0 0 0 0 19 20 2 0 0 0 0 19 72 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 73 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 27 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 25 48 2 0 0 0 0 26 44 1 0 0 0 0 26 74 1 0 0 0 0 27 32 1 0 0 0 0 27 75 1 0 0 0 0 28 31 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 28 78 1 0 0 0 0 29 79 1 0 0 0 0 30 32 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 39 1 0 0 0 0 34 80 1 0 0 0 0 35 36 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 40 1 0 0 0 0 36 83 1 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 40 86 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 87 1 0 0 0 0 43 88 1 0 0 0 0 43 89 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 2 0 0 0 0 46 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 49 57 1 0 0 0 0 49 58 1 0 0 0 0 51 53 1 0 0 0 0 51 93 1 0 0 0 0 52 94 1 0 0 0 0 53 54 2 0 0 0 0 53 55 1 0 0 0 0 55 95 1 0 0 0 0 55 96 1 0 0 0 0 55 97 1 0 0 0 0 56 98 1 0 0 0 0 56 99 1 0 0 0 0 56100 1 0 0 0 0 57101 1 0 0 0 0 57102 1 0 0 0 0 57103 1 0 0 0 0 58104 1 0 0 0 0 58105 1 0 0 0 0 58106 1 0 0 0 0 M END > 367 $$$$ ATCMD MOE2008 3D 83 86 0 0 1 0 0 0 0 0999 V2000 -1.4060 -1.6210 -1.5810 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6420 -1.7710 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 1.8230 -2.1920 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7230 2.7540 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.8950 -1.9260 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8960 -0.5180 -2.5540 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3410 -1.0190 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -0.8320 -2.6210 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5860 -1.3110 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 0.6670 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 0.9820 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 0.8620 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 1.5390 -2.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4770 1.6740 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 1.2230 -1.9390 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4620 0.4850 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -1.5890 -0.8660 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5970 0.7700 -0.4810 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2230 -0.7000 0.2660 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0110 0.5500 -0.0790 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1090 -1.5820 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -2.6100 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -1.3090 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -0.6740 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.5160 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.8440 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -1.6150 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 1.6430 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 1.3640 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 1.7950 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 2.5970 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.8480 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 0.3500 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.8550 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 0.3110 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 -1.9770 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -2.6710 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -2.6120 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -1.6500 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -0.0860 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 0.7270 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -0.7240 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -1.4610 -3.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -0.4080 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 2.3520 -2.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -2.6170 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 2.1490 -3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 3.4620 -3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 3.5690 -5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 4.5910 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 3.3310 -5.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 2.8940 -5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 2.8310 -2.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -0.8940 -1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 0.4410 1.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 1.9240 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 2.7090 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -2.8370 -2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 3.8650 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 3.7390 -4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 3.5680 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 2.9560 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 4.6830 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 4.8710 -1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 2.5360 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 1.3770 -4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 1.1040 -4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 1.6670 -5.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 0.5300 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 3.6160 -3.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 4.4190 -3.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -3.9380 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -5.0490 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -4.7440 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -5.3170 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -5.9260 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -4.0330 -0.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -1.7100 -2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -2.3780 -3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -2.5670 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 -1.7260 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -3.3340 -3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -1.4350 -1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 17 1 0 0 0 0 1 58 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 47 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 25 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 45 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 56 1 0 0 0 0 19 36 1 0 0 0 0 19 40 1 0 0 0 0 20 24 1 0 0 0 0 20 28 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 54 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 55 1 0 0 0 0 43 78 1 0 0 0 0 45 65 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 48 71 2 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 53 59 1 0 0 0 0 56 57 1 0 0 0 0 58 72 1 0 0 0 0 59 60 1 0 0 0 0 59 64 2 0 0 0 0 60 61 1 0 0 0 0 60 62 1 0 0 0 0 60 63 1 0 0 0 0 65 66 1 0 0 0 0 65 70 2 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 1 0 0 0 0 72 73 1 0 0 0 0 72 77 2 0 0 0 0 73 74 1 0 0 0 0 73 75 1 0 0 0 0 73 76 1 0 0 0 0 78 79 1 0 0 0 0 78 83 2 0 0 0 0 79 80 1 0 0 0 0 79 81 1 0 0 0 0 79 82 1 0 0 0 0 M END > 368 $$$$ 369 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 97101 0 0 1 0 0 0 0 0999 V2000 -0.2180 0.1620 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -5.0110 -2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -5.6180 -4.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -5.6910 -5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -5.1650 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -4.5620 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -4.4810 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 2.3080 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -5.0920 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -7.0700 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 0.1700 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.3160 1.6780 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1360 -4.2860 0.2980 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2480 -1.2860 0.5340 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5320 -3.2450 1.9020 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0640 -1.8640 1.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3400 -2.6280 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -3.6170 3.2140 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4880 -1.6640 -0.2010 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9540 -3.0560 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -3.0800 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -1.7080 -0.1640 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6800 -0.7380 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -4.3190 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -4.1190 2.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -1.2560 3.7640 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6900 -0.8300 2.7360 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8570 -0.1780 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -0.1870 3.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 0.1830 3.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -1.4430 0.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -4.9500 3.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -3.3260 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.3360 -0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.5500 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -2.0920 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.0810 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -2.3070 -2.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 0.8020 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -5.6780 4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -5.2160 5.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -5.2180 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -6.3090 2.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.2200 4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 0.7900 4.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -1.3920 4.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -4.9230 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -5.3800 -2.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -1.7740 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -1.5280 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3540 -2.2680 -0.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -6.0300 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -6.1610 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -5.2250 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -4.1530 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -4.0110 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 2.6870 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 2.6400 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 2.6870 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -4.9930 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -5.9810 4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -4.2110 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -7.0250 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -7.6790 4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -7.5140 3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -5.2970 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -5.1630 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -1.5900 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -1.9470 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.9470 4.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -2.5770 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -3.6060 4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -1.6210 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -0.3960 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 0.1050 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -4.4300 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 -4.2320 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -5.1910 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -1.1080 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -0.8260 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 0.8210 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -3.0110 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -2.6720 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -4.3520 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -1.4150 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -2.1690 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -3.0770 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.2340 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.0360 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 0.5330 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.2800 -2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 1.7870 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 0.5530 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 0.7610 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -0.5320 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 -2.2740 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -1.6000 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 2 47 1 0 0 0 0 3 4 2 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 53 1 0 0 0 0 5 6 2 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 55 1 0 0 0 0 7 56 1 0 0 0 0 8 39 1 0 0 0 0 8 57 1 0 0 0 0 8 58 1 0 0 0 0 8 59 1 0 0 0 0 9 42 1 0 0 0 0 9 60 1 0 0 0 0 9 61 1 0 0 0 0 9 62 1 0 0 0 0 10 40 1 0 0 0 0 10 63 1 0 0 0 0 10 64 1 0 0 0 0 10 65 1 0 0 0 0 11 39 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 12 66 1 0 0 0 0 13 20 1 0 0 0 0 13 34 1 0 0 0 0 13 67 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 14 68 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 27 1 0 0 0 0 16 69 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 70 1 0 0 0 0 17 71 1 0 0 0 0 18 32 1 0 0 0 0 18 72 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 22 73 1 0 0 0 0 23 74 1 0 0 0 0 23 75 1 0 0 0 0 24 76 1 0 0 0 0 24 77 1 0 0 0 0 24 78 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 79 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 80 1 0 0 0 0 28 81 1 0 0 0 0 30 44 1 0 0 0 0 31 49 1 0 0 0 0 32 40 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 34 47 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 37 88 1 0 0 0 0 37 89 1 0 0 0 0 37 90 1 0 0 0 0 38 91 1 0 0 0 0 40 41 2 0 0 0 0 42 43 2 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45 92 1 0 0 0 0 45 93 1 0 0 0 0 45 94 1 0 0 0 0 47 48 2 0 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 50 95 1 0 0 0 0 50 96 1 0 0 0 0 50 97 1 0 0 0 0 M END > 369 $$$$ 370 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3980 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 2.0930 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 1.5740 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 0.0710 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -0.5710 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0030 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -0.6760 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0840 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.7190 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -2.1330 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -2.8360 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.2320 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -4.9060 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -4.2200 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -2.8570 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -2.7240 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -1.9610 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -2.8030 -2.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -4.1000 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -4.0430 -1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 2.0830 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 3.5850 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 1.4900 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 3.1650 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 1.9000 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 1.8760 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 1.9990 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 0.0070 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -0.2010 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -4.7760 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -5.9860 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -4.7720 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -2.3360 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -4.2600 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -4.8830 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 3.9280 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 4.0270 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 3.8860 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 5 17 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 8 11 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END > 370 $$$$ 371 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 110115 0 0 1 0 0 0 0 0999 V2000 0.3930 2.7870 -3.7200 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3860 1.2910 -4.0430 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8120 0.8400 -4.3700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7260 1.1740 -3.1870 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6430 2.6750 -2.8970 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2860 3.0330 -2.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 2.9850 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 3.2330 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 4.6490 -3.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -0.5710 -4.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 0.8230 -3.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.0500 -5.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 4.7450 -0.1490 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6240 4.3890 -1.5340 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1040 4.7380 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 6.2360 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 6.5460 0.0980 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3960 6.1550 -1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8790 6.5150 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 8.0500 -1.2260 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0160 8.0460 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 8.5680 0.0870 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1450 10.3080 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 8.8250 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 3.7030 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 4.6310 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 5.8580 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 9.8020 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 10.5920 1.2810 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5580 10.0770 0.2470 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9830 10.4680 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1410 11.9800 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 12.0770 1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1610 12.4820 1.8560 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9740 14.0140 1.9020 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6220 14.1870 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 12.8110 2.5570 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5670 12.9620 2.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 14.6450 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 14.4320 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8240 16.1440 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 8.3800 -1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 10.7350 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6060 12.0460 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 8.1160 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 4.4560 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 4.1780 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 4.2650 2.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 3.7570 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 3.3460 -4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.7340 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 1.3600 -5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.6150 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 3.2320 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 2.9650 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 2.7380 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 4.9920 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -0.9250 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 1.0080 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 0.1200 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 4.1470 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 4.9350 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 6.8170 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 6.4900 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 6.8220 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 6.0840 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 6.1710 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 8.4460 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 10.8550 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 10.6100 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 8.3980 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 2.7360 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 4.0140 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 3.6210 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 5.2790 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 4.9400 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 3.6000 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 4.7980 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 5.9680 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 6.3160 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 8.7630 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 9.8450 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 10.2370 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 9.9660 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 10.1390 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 12.1970 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 12.4900 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 12.5890 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 14.4140 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 14.5010 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 14.9190 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 12.3200 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 13.4180 2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1140 14.1790 3.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3480 14.7340 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 15.0320 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7060 13.3780 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 16.2960 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 16.5950 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 16.6100 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8090 8.0720 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 10.4810 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 11.8170 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 10.3750 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 12.5430 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 12.3180 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 10.9660 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 3.6500 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 2.8040 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 4.5130 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 54 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 55 1 0 0 0 0 8 56 1 0 0 0 0 9 57 1 0 0 0 0 10 58 1 0 0 0 0 11 59 1 0 0 0 0 12 60 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 62 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 63 1 0 0 0 0 16 64 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 65 1 0 0 0 0 19 20 1 0 0 0 0 19 66 1 0 0 0 0 19 67 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 20 68 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 30 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 23 69 1 0 0 0 0 23 70 1 0 0 0 0 24 71 1 0 0 0 0 25 72 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 75 1 0 0 0 0 26 76 1 0 0 0 0 26 77 1 0 0 0 0 27 78 1 0 0 0 0 27 79 1 0 0 0 0 27 80 1 0 0 0 0 28 29 1 0 0 0 0 28 81 1 0 0 0 0 28 82 1 0 0 0 0 28 83 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 43 1 0 0 0 0 31 32 1 0 0 0 0 31 84 1 0 0 0 0 31 85 1 0 0 0 0 32 34 1 0 0 0 0 32 86 1 0 0 0 0 32 87 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 33 88 1 0 0 0 0 34 35 1 0 0 0 0 34 44 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 89 1 0 0 0 0 36 37 1 0 0 0 0 36 90 1 0 0 0 0 36 91 1 0 0 0 0 37 38 1 0 0 0 0 37 92 1 0 0 0 0 38 93 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 94 1 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 41 98 1 0 0 0 0 41 99 1 0 0 0 0 41100 1 0 0 0 0 42101 1 0 0 0 0 43102 1 0 0 0 0 43103 1 0 0 0 0 43104 1 0 0 0 0 44105 1 0 0 0 0 44106 1 0 0 0 0 44107 1 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 49108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 M END > 371 $$$$ 372 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 0.4600 0.3740 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.9860 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -1.5080 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.2890 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 0.7790 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -0.5990 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -0.8600 -0.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 1.4800 -0.3900 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0290 0.3440 -0.0130 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2680 0.6100 -0.7690 N 0 0 1 0 0 0 0 0 0 0 0 0 5.8430 1.2440 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 2.1140 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 1.5160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 2.7760 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 2.7120 1.3480 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6680 1.4670 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 0.2070 1.4780 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1450 -0.8330 1.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 2.5060 0.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4480 3.8120 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 2.0030 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 4.8700 0.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 3.9080 -1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 2.9260 2.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 3.8860 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 5.1650 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 6.0960 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 2.6280 3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 1.6290 3.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 3.5390 5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 0.7360 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.6620 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -2.5740 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.3530 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -1.6900 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 1.8670 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 0.4830 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 2.0870 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 3.1400 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4650 1.0460 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0340 1.7560 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 3.6100 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 1.4180 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 1.5380 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.0920 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 -1.0440 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 1.9380 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 1.0180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 3.8830 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 5.1060 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 6.0040 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 5.3090 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 6.8690 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 6.4230 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 5.9160 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 4.3810 4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 3.9080 5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 2.9870 6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 3 6 2 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 25 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 27 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END > 372 $$$$ 373 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 100106 0 0 1 0 0 0 0 0999 V2000 0.6400 2.2890 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 0.9660 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.4940 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 1.3310 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 2.6440 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 3.1280 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 5.5230 -5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 4.6150 -6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 4.9080 -7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 6.0990 -7.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 7.0030 -6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1370 6.7220 -5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 7.6730 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 7.0250 -4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 7.6380 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 7.2600 -2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 6.9930 -3.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1530 6.8010 -1.8050 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8700 4.9240 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 5.7220 -3.5630 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2410 5.6290 -1.0510 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0760 6.5810 -0.6360 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8320 7.7990 -0.0560 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8230 7.4270 1.0850 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3480 4.5490 0.0370 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1350 5.0500 1.2500 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3830 6.2400 1.9260 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1320 6.2920 3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 4.8030 3.6900 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2260 4.0030 2.3690 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2250 8.4140 -4.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 7.4980 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 9.1480 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 7.8610 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 6.0910 -4.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 5.2130 -5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 4.1660 -5.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 3.7140 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 5.7600 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 6.0750 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 9.0940 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 7.9260 -1.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 6.5840 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 7.4940 0.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 4.0750 0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 5.3530 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.0940 2.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 4.3910 4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 1.8600 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 0.8620 2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 1.5500 3.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 2.8020 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 2.0770 -0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 8.6850 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 8.8070 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 9.6590 1.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 6.0840 2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 10.2580 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 0.3120 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -0.5290 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 0.9570 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 3.2910 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 4.1530 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 3.6860 -7.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 4.2070 -8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6580 6.3230 -7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 7.9310 -6.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 7.4290 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 7.6030 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 6.0050 -4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 5.1130 -4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 8.2980 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 3.6980 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 6.8420 4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 6.7360 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 4.6300 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 3.4410 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 6.5050 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 8.2530 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 7.6100 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 9.6640 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 9.6040 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 9.2290 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 9.6970 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 9.6550 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 8.8480 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 6.5090 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 6.3210 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 4.9820 5.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 3.3330 4.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 4.5650 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 0.9980 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -0.1490 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.0130 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 8.5070 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 8.1610 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 6.8400 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 10.3470 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 10.5580 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 10.9040 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 52 1 0 0 0 0 2 3 2 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 60 1 0 0 0 0 4 5 2 0 0 0 0 4 61 1 0 0 0 0 5 6 1 0 0 0 0 5 62 1 0 0 0 0 6 63 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 64 1 0 0 0 0 9 10 1 0 0 0 0 9 65 1 0 0 0 0 10 11 2 0 0 0 0 10 66 1 0 0 0 0 11 12 1 0 0 0 0 11 67 1 0 0 0 0 12 68 1 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 69 1 0 0 0 0 14 70 1 0 0 0 0 15 16 1 0 0 0 0 15 31 2 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 18 22 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 38 2 0 0 0 0 20 35 1 0 0 0 0 20 71 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 27 1 0 0 0 0 24 44 1 0 0 0 0 24 72 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 73 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 76 1 0 0 0 0 30 47 1 0 0 0 0 30 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 41 84 1 0 0 0 0 41 85 1 0 0 0 0 41 86 1 0 0 0 0 42 43 1 0 0 0 0 43 87 1 0 0 0 0 43 88 1 0 0 0 0 44 54 1 0 0 0 0 45 52 1 0 0 0 0 47 49 1 0 0 0 0 48 89 1 0 0 0 0 48 90 1 0 0 0 0 48 91 1 0 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 50 92 1 0 0 0 0 50 93 1 0 0 0 0 50 94 1 0 0 0 0 52 53 2 0 0 0 0 54 55 1 0 0 0 0 54 56 2 0 0 0 0 55 58 1 0 0 0 0 55 95 1 0 0 0 0 55 96 1 0 0 0 0 57 97 1 0 0 0 0 58 98 1 0 0 0 0 58 99 1 0 0 0 0 58100 1 0 0 0 0 M END > 373 $$$$ 374 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 58 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.2790 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.0600 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.9360 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.1410 -0.7160 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7180 -0.1960 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 0.4060 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 1.3360 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 2.6200 -2.5760 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4030 2.6320 -2.1800 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8740 4.0660 -2.2970 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8670 5.0300 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 6.4370 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 7.3870 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 8.0370 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 1.9300 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 0.1120 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 3.7620 -3.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 4.3140 -3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 5.4990 -4.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 3.8600 -2.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 4.4280 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 3.3400 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 3.1130 -0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 3.4540 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 7.7700 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 9.0500 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.5720 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -0.8650 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.9590 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 1.5840 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.1710 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 1.2970 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 1.1780 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 2.7180 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 1.9880 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 4.1400 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 4.7030 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 5.0420 -2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 6.7640 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 6.4250 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 7.5320 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 1.3560 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -0.9530 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 0.6810 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 0.3970 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 6.4190 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 5.4860 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 5.4500 -5.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 3.6720 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 5.3990 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 4.4710 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 4.0940 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 6.9110 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 8.6450 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 7.5620 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 10.0310 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 9.0910 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 8.7630 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 9 1 0 0 0 0 4 22 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 23 2 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 24 2 0 0 0 0 22 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 M END > 374 $$$$ 375 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.6730 1.9460 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 0.8470 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.8550 -2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 1.9620 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 3.0620 -1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 3.0530 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.9390 -0.8220 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2610 2.5090 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 2.1630 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 1.0360 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 0.2600 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 0.6100 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 1.7330 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 2.1130 0.7000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7370 1.3950 1.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 3.6000 0.9720 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5230 3.1200 -1.3880 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9560 3.9920 -0.1890 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2200 2.1260 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 3.4830 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 4.4180 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 4.0270 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 2.6970 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 1.7240 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 0.6940 2.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -0.4780 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 5.7190 3.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 6.6300 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 2.3090 5.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 3.3220 6.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 4.4490 1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 3.7240 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 2.6120 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 3.2960 -3.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 1.5870 -1.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 4.7710 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 4.5620 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 5.8810 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -0.0190 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -0.0040 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 1.9680 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 3.9270 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 3.9120 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 1.0010 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 3.3830 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 2.7690 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -0.6170 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 0.0060 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 3.6980 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 5.0470 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 4.7540 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 0.6950 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -0.3520 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -0.6370 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -1.3400 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 6.6350 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 6.3180 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 7.6320 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 3.7710 6.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 4.0890 5.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 2.8790 7.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 5.3640 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 4.0780 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 3.0060 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 4.1280 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 5.5190 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 3.8860 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 43 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 49 1 0 0 0 0 18 32 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 M END > 375 $$$$ 376 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 66 0 0 1 0 0 0 0 0999 V2000 0.6110 0.7880 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.4420 -0.1730 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9020 -1.6580 0.6210 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2710 -1.6280 2.0170 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2530 -1.5960 1.8800 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6360 -0.4580 1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -0.4560 -0.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9390 -0.4980 -1.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -1.6140 0.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -2.7960 2.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -1.5110 3.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -0.3780 2.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -0.1630 2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -1.8510 4.5580 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8900 -0.8110 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 -0.5070 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -1.5880 3.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7930 -1.7090 4.6080 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4180 -0.4550 5.3990 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8970 -0.3840 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 0.7220 4.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 1.7900 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 3.0480 4.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 -1.2430 4.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 -0.9580 4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 0.4180 3.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 1.7420 6.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 0.7160 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 1.7380 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.7340 -1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 2.6620 -2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -1.6590 5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -3.6800 6.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -2.7640 6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -2.7310 8.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 0.8360 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 1.6790 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 0.4710 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -2.5720 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.7380 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.5050 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -1.3500 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -0.4980 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -2.3560 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -2.8430 3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 0.5670 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -2.8440 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -2.4550 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -2.5880 5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -0.4950 6.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -1.3420 5.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 0.3990 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -0.1590 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 3.4260 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 3.8000 5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 2.8280 4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8410 -1.1150 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 0.0790 4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0040 -1.6190 5.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 0.8580 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 2.6380 -2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 1.7010 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -1.6850 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -0.6970 6.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -3.4620 8.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 28 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 42 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 16 24 1 0 0 0 0 16 26 2 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 32 34 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 65 1 0 0 0 0 M END > 376 $$$$ 377 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 123130 0 0 1 0 0 0 0 0999 V2000 2.1010 2.9430 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 1.4910 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 0.9030 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 2.0010 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 3.2480 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0110 -5.8470 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 -5.9050 0.7510 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6600 -4.4900 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 -4.9830 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 -3.5690 2.4070 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9200 -3.6260 1.5480 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3040 -2.2110 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 -1.5990 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -2.9570 1.5940 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8960 -1.5430 1.1580 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1120 -2.3200 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 -2.8710 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -0.9020 1.1440 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7770 -0.8660 0.4060 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4700 -1.5460 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -1.0130 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.5770 0.0200 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9180 -2.7070 3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -0.9500 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 0.1070 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 0.4940 0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -3.5710 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7340 -4.0590 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.7510 0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 -6.4720 1.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7310 -16.4660 5.8980 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6390 -17.3650 5.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0330 -18.7170 5.4560 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8070 -19.2460 6.6660 C 0 0 2 0 0 0 0 0 0 0 0 0 14.0180 -18.3440 6.9220 C 0 0 2 0 0 0 0 0 0 0 0 0 13.5330 -16.9050 7.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9470 -12.5890 3.7170 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3570 -12.3970 3.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9300 -13.0160 4.9960 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7080 -14.5290 4.9250 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2070 -14.8130 4.8190 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6460 -14.0850 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 -7.8940 1.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2780 -8.4950 1.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 -9.9220 1.9020 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4560 -10.4870 2.6740 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7500 -9.9060 2.0950 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6840 -8.3770 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7890 -19.5780 5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4300 -12.7210 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -10.4510 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2520 -20.5780 6.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9140 -18.3970 5.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2220 -18.2180 6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 -14.3440 5.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2290 -15.1440 6.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 -11.9100 2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8920 -10.3190 0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2130 -18.2610 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6050 -18.0230 7.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 0.9780 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 1.9950 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 1.8700 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -5.4140 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 -6.8550 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0920 -6.5210 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5610 -4.5300 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 -4.0570 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3680 -4.9420 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 -5.4170 3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 -1.5970 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2040 -2.2520 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -0.5910 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 -2.2120 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.9670 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -2.3010 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -3.8640 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -2.2050 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 -1.2500 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 -2.6300 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -0.1600 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -1.8010 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -1.1340 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7310 -3.1420 4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1920 -1.6990 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -2.6660 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 -0.2260 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 1.0820 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 0.1850 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 0.5970 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3760 -16.4760 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6690 -18.7570 4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1590 -19.2440 7.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5420 -18.6820 7.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3920 -16.2460 7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9000 -16.8560 8.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 -12.1880 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4540 -12.6210 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2170 -14.9300 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 -15.8850 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 -14.2360 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1130 -14.4770 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5200 -8.1760 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -10.2310 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -10.2130 3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6010 -10.2600 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5770 -7.9540 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 -8.0600 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 -19.2000 4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0900 -20.6090 5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 -19.5380 6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5870 -11.6500 5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8810 -13.2580 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8930 -13.0460 4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -10.1120 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -11.5410 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 -10.0780 3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 -21.2040 6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -14.4920 5.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6920 -9.9860 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3380 -17.2590 4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1720 -18.6250 5.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8450 -18.9290 4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 29 2 0 0 0 0 2 3 2 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 62 1 0 0 0 0 4 63 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 64 1 0 0 0 0 6 65 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 66 1 0 0 0 0 8 11 1 0 0 0 0 8 67 1 0 0 0 0 8 68 1 0 0 0 0 9 10 1 0 0 0 0 9 69 1 0 0 0 0 9 70 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 71 1 0 0 0 0 12 72 1 0 0 0 0 13 15 1 0 0 0 0 13 73 1 0 0 0 0 13 74 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 27 1 0 0 0 0 15 19 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 75 1 0 0 0 0 16 76 1 0 0 0 0 17 77 1 0 0 0 0 17 78 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 79 1 0 0 0 0 20 80 1 0 0 0 0 21 22 1 0 0 0 0 21 81 1 0 0 0 0 21 82 1 0 0 0 0 22 83 1 0 0 0 0 23 84 1 0 0 0 0 23 85 1 0 0 0 0 23 86 1 0 0 0 0 25 87 1 0 0 0 0 25 88 1 0 0 0 0 25 89 1 0 0 0 0 26 90 1 0 0 0 0 30 43 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 31 56 1 0 0 0 0 31 91 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 49 1 0 0 0 0 33 92 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 34 93 1 0 0 0 0 35 36 1 0 0 0 0 35 53 1 0 0 0 0 35 94 1 0 0 0 0 36 95 1 0 0 0 0 36 96 1 0 0 0 0 37 38 1 0 0 0 0 37 42 1 0 0 0 0 37 57 1 0 0 0 0 37 97 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 50 1 0 0 0 0 39 98 1 0 0 0 0 40 41 1 0 0 0 0 40 56 1 0 0 0 0 40 99 1 0 0 0 0 41 42 1 0 0 0 0 41 55 1 0 0 0 0 41100 1 0 0 0 0 42101 1 0 0 0 0 42102 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 43103 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 51 1 0 0 0 0 45104 1 0 0 0 0 46 47 1 0 0 0 0 46 57 1 0 0 0 0 46105 1 0 0 0 0 47 48 1 0 0 0 0 47 58 1 0 0 0 0 47106 1 0 0 0 0 48107 1 0 0 0 0 48108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 49111 1 0 0 0 0 50112 1 0 0 0 0 50113 1 0 0 0 0 50114 1 0 0 0 0 51115 1 0 0 0 0 51116 1 0 0 0 0 51117 1 0 0 0 0 52118 1 0 0 0 0 53 54 1 0 0 0 0 54 59 1 0 0 0 0 54 60 2 0 0 0 0 55119 1 0 0 0 0 58120 1 0 0 0 0 59121 1 0 0 0 0 59122 1 0 0 0 0 59123 1 0 0 0 0 M END > 377 $$$$ 378 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 -1.0360 -3.0200 -0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 1.4870 0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1580 2.0700 -2.5690 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2920 2.1720 -2.1360 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5010 2.2820 -0.6360 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1510 3.6690 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 2.0420 -0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 1.0920 -2.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 2.3060 -0.0740 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8740 1.8460 0.8390 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1320 2.5160 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 2.4750 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 1.8100 -1.7640 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1760 2.4420 -1.5230 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9980 2.1270 -3.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 2.9430 -1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 3.8660 -1.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 3.6670 -0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 0.3380 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.3970 -0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6520 0.0150 0.2180 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3180 -0.7630 -0.6740 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1000 -2.2470 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.7340 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -1.8850 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -2.4470 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -0.4480 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.4380 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 1.3140 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 0.2390 -4.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 2.3750 -4.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 0.7540 -3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 1.7370 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 2.8550 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 3.1090 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 3.6480 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 4.4990 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 2.5430 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 2.0970 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 0.7440 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 1.8220 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 4.0690 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 0.1830 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -0.1000 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -0.1690 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.5460 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -3.7960 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -2.5300 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -3.4330 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -1.7840 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -0.9110 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -0.1530 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.5200 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 0.0430 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -0.0100 -3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 0.5990 -5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -0.6490 -4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -0.0720 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.6240 -4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 0.7730 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 5 1 0 0 0 0 2 9 1 0 0 0 0 2 21 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 32 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 35 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 6 9 1 0 0 0 0 6 18 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 14 17 1 0 0 0 0 15 41 1 0 0 0 0 17 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 M END > 378 $$$$ 379 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 2.0420 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 1.4850 1.2230 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6020 1.9510 1.2400 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1440 -0.0420 1.1900 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7420 -0.5130 1.1580 N 0 0 3 0 0 0 0 0 0 0 0 0 0.6880 -1.9800 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -2.5820 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -2.0770 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.5430 -0.0740 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3350 1.4960 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 0.0000 -0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2320 -0.7540 0.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 -0.7960 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -0.2170 -1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 -1.5640 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.2340 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.5820 2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 1.5020 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 0.0360 2.8550 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2590 -0.1160 4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 1.8280 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8880 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -0.3700 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -0.3560 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 1.7160 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 3.1320 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 3.0590 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -2.3360 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -2.3000 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -3.6700 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -2.2990 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.4340 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.4420 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 2.0380 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 1.7690 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -0.1400 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -2.0150 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -2.3470 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -0.8870 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -0.4360 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -1.6700 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 1.7250 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 2.1070 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -0.5450 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.4840 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -1.1630 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 0.2240 4.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 7 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 5 12 1 0 0 0 0 5 20 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 M END > 379 $$$$ 380 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 -0.9150 -0.3100 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 0.1760 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -0.6680 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -1.9960 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -1.6550 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.5030 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 1.4730 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 0.5850 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 1.1410 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 0.8170 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -2.1310 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -3.9060 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -4.9640 0.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1160 -4.2190 2.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -6.3010 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -7.3460 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -5.1020 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.8120 0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.1380 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 2.4040 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 3.7880 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 4.5640 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 5.8980 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 4.1230 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 6.9920 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 8.3260 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 9.0420 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 8.4800 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 10.4280 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 0.3100 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 0.4240 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 1.8870 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -2.4840 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -4.6790 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -6.1800 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -6.6300 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -8.2990 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -7.4670 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -7.0170 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -5.3870 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -4.1490 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -5.8670 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -2.8350 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 0.2400 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -0.9390 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 0.6700 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 2.3950 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 2.1240 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 4.1380 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 6.1120 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 5.8710 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 3.5580 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 4.9990 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 3.4940 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 6.7780 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 7.0190 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 8.6910 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 8.6470 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 8.9760 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 7.4100 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 10.3730 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 11.0460 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 10.8680 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 2 0 0 0 0 3 19 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 M END > 380 $$$$ 381 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 -1.7900 -2.9950 0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 1.4110 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2510 3.7220 -1.7420 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6120 2.5120 -2.0980 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1170 1.8920 -0.8020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2630 2.9150 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 2.8790 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 1.5790 -2.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 2.1830 0.0180 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5140 1.2980 0.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7620 2.0250 0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 3.0140 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 3.4060 -1.6660 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4510 3.3510 -0.9090 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0650 4.7580 -2.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 3.6190 -0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 4.4650 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.1170 -0.7760 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2020 -0.5360 -0.9770 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1740 -0.1000 0.0560 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1660 -0.7850 -0.2900 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9440 -2.2820 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -2.8360 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -2.0300 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.6670 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -0.3780 0.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.6080 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 4.4360 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.2130 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 0.5390 -2.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 0.4540 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 0.8740 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 0.0410 -1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 1.6190 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 4.4120 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 2.8540 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 1.0810 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 2.1860 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 3.4420 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 3.6300 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 3.2430 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.7910 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 0.8890 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 2.7630 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 4.8520 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 5.3210 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -0.6180 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.5430 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -3.9060 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -2.8500 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -3.6130 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -2.0010 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -0.7710 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.2490 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -1.6980 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -0.2370 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 3.7880 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 4.6720 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 5.3560 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 1.9240 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 0.7350 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 0.2660 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 5 1 0 0 0 0 2 9 1 0 0 0 0 2 20 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 28 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 36 1 0 0 0 0 5 7 1 0 0 0 0 5 37 1 0 0 0 0 6 9 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 14 17 1 0 0 0 0 15 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 M END > 381 $$$$ 382 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -1.2410 1.1530 0.6480 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1680 -0.3760 0.7150 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0880 -0.7800 1.7220 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2460 -0.1530 1.3080 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1000 1.2670 1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 1.7060 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -0.4800 2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 1.5420 -0.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -0.8960 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.2040 1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -0.0360 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 0.1430 2.7110 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9180 -0.3140 3.7840 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9300 -1.8450 3.8330 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5100 -2.3500 4.1030 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6320 -1.8640 3.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -0.4390 3.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8510 1.5700 2.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 0.1640 3.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 -2.2820 4.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.7800 4.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -5.6290 5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -4.2560 5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -3.6420 4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -4.3920 4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -6.4240 4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -5.7990 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -6.5920 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -7.8310 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -8.5860 4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -7.9840 4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 -8.8210 3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 -9.2360 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -10.0890 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -9.1810 4.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -6.0120 3.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -6.2140 5.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 1.5460 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.7720 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -0.4260 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -0.5390 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 1.3440 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 2.7950 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 2.5000 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -0.6720 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -2.5310 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -0.4960 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 1.0480 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 -0.2100 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 0.0800 4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -2.2380 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -1.9910 5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -0.0540 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 2.0060 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9060 -0.0890 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -3.2430 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -3.6490 5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -2.5640 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -8.3080 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -8.8970 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 -8.7900 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 -10.3220 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -10.4510 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -10.5180 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -10.3840 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 -5.8500 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -6.3860 6.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 11 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 46 1 0 0 0 0 11 17 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 17 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 58 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 28 31 2 0 0 0 0 28 36 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 35 2 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 M END > 382 $$$$ 383 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0040 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6850 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.1100 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4170 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0090 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -0.6710 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -0.0250 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 1.3220 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.1420 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 3.3320 -0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 -0.9100 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 0.2130 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 2.1180 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 1.5020 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 3.6200 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5520 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -1.7650 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.1900 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 1.1600 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 1.8380 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -1.8660 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 -0.4160 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -1.0780 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 0.8440 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 0.7060 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -0.7430 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 3.9850 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 4.0530 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 3.9080 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 6 2 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 M END > 383 $$$$ 384 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 72 77 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5530 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 1.9930 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8400 2.2560 -1.4820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4690 -0.3820 -0.2890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8820 -1.7520 0.1770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4370 -2.1210 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -1.8280 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.3540 1.4750 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7080 -0.2360 -1.7820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2090 1.1300 -2.2980 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8070 1.1190 -3.7300 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2730 0.7070 -3.4360 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1760 -0.2600 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 0.7320 0.4870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5920 0.5280 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 0.5060 1.9180 N 0 0 3 0 0 0 0 0 0 0 0 0 3.3610 2.3120 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 1.9810 -2.9050 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6670 2.3920 -4.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -1.8560 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 3.0810 -3.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 3.5430 -1.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 1.3830 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 0.9460 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -3.1800 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 4.6310 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 5.9900 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 4.5200 -0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 2.3740 -5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.6660 -6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 1.3220 -6.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 3.9590 -3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 1.1850 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 0.2550 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.9330 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.9320 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 2.8710 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -0.4460 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.4900 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.1920 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -1.5670 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.4300 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.0740 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.1220 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -1.0290 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 0.3350 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 0.0610 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -1.2700 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 0.7240 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 1.5480 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 0.1410 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 3.3590 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 1.7120 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 1.7540 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 1.3180 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 2.4120 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -0.0830 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 1.5970 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 1.0110 4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -3.1740 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -3.8440 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -3.5310 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 6.1960 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 6.7480 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 6.0100 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 4.0440 -6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 3.4910 -7.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 4.3990 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 4.7730 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 4.3680 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 3.4050 -4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 38 1 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 16 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 35 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 17 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 22 1 0 0 0 0 19 55 1 0 0 0 0 20 30 1 0 0 0 0 21 26 1 0 0 0 0 22 33 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 M END > 384 $$$$ 385 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 2.0320 1.5890 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 0.0840 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.5570 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -0.5460 -1.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -2.5970 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -3.0760 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -3.3610 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -2.6350 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.9890 -0.0360 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4820 -2.3040 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -4.0720 -1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.6500 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -3.8320 1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -2.0510 1.9660 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4350 -1.7150 4.2700 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9120 -2.0410 4.4590 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5190 -3.2150 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -2.8240 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -1.8580 1.9410 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6210 -2.6150 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -0.9450 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.3130 5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.3660 6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -3.7550 5.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -1.0410 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -3.5950 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.5340 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 1.9780 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 1.9000 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 1.9780 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -2.6730 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.6060 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -1.9430 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -2.4070 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.6620 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -1.1850 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -4.0560 4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -3.5330 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -2.3430 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -3.7210 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 -3.2060 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -1.5530 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -0.2460 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -0.3900 2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -0.5230 6.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.0010 7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -1.9010 7.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -4.0360 6.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -3.8410 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -4.4160 5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -0.4270 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -4.2050 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -4.2000 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -2.7550 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.1800 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -0.1880 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.1450 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 9 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 27 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 M END > 385 $$$$ 386 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 94 0 0 1 0 0 0 0 0999 V2000 1.6030 2.6670 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.3810 -0.8930 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7770 0.4330 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 2.3450 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 1.5040 1.2710 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1350 0.2300 0.9450 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0950 -0.6870 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -1.1440 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 1.1110 1.6790 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4080 0.0650 2.7890 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6650 1.9020 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 2.3280 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7170 0.8880 3.2780 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8640 -0.3540 2.9120 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2130 -1.2720 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 -1.1420 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 0.2690 3.5810 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2420 2.3630 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 1.3500 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.7020 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 1.1100 4.6490 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0260 1.1180 5.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5530 1.4390 7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8960 0.7440 7.3280 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8320 1.0160 6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1900 0.4740 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 2.9480 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6890 -0.6630 7.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -1.0110 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 0.9150 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.9280 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 2.2670 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 1.8600 -3.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 0.9290 8.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9930 2.5200 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 0.6230 4.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.9280 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -0.3100 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 0.6580 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 0.2000 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 3.2840 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 3.2370 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 0.8750 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 1.7750 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 3.2700 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.1840 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -1.5770 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -1.8250 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -1.6680 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 1.4990 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 2.7840 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1410 3.0220 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 2.8320 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -0.9240 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 -2.2980 3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 -1.2200 5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 -1.9110 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 2.8630 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 1.7310 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 3.1090 2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3440 1.1330 8.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0270 2.0810 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7820 0.5000 6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0790 -0.6100 4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8360 0.6970 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7310 3.4270 7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 3.1490 8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 3.3450 6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4990 -1.1670 7.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 -0.3060 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -1.2960 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -1.8980 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 0.9390 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 0.2350 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.9160 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 2.2820 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 3.2470 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 1.5160 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -0.1500 8.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 1.1660 9.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 1.4120 8.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 2.9990 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 3.1070 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4590 2.4590 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 -0.0850 4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 1.5720 4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 0.7800 4.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.2910 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -1.6480 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.8020 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 30 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 14 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 21 1 0 0 0 0 17 40 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 37 88 1 0 0 0 0 37 89 1 0 0 0 0 37 90 1 0 0 0 0 M END > 386 $$$$ 387 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 94 0 0 1 0 0 0 0 0999 V2000 1.5890 2.6720 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 1.3860 -0.8960 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7670 0.4330 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 2.3510 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 1.5060 1.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1250 0.2300 0.9390 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0860 -0.6910 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.1450 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 1.1150 1.6800 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3950 0.0660 2.7870 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6470 1.9130 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 2.3340 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 0.8940 3.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8520 -0.3490 2.9120 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2010 -1.2700 4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -1.1360 4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 0.2780 3.5880 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2240 2.3590 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 1.3510 4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.7060 -1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 1.1180 4.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0020 1.1210 5.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 1.4380 7.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8700 0.7440 7.3390 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8080 1.0320 6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1700 0.4850 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 2.9460 7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4520 1.2380 8.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 0.2140 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3680 -1.0000 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 0.9090 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.9370 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 2.2750 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 1.8730 -3.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 0.9190 8.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 2.5300 4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 0.6190 4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.9270 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -0.3060 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 0.6680 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 3.2930 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 3.2380 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 0.8840 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 1.7850 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.2760 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.1920 3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -1.5820 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -1.8270 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -1.6660 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 1.5150 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 2.7960 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 3.0330 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 2.8310 2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 -0.9240 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -2.2960 3.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 -1.2150 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 -1.9020 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 2.8580 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 1.7240 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 3.1060 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 -0.3320 7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9920 2.0980 6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7620 0.5220 6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0590 -0.5990 4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 0.7060 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 3.4230 7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 3.1430 8.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 3.3480 6.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3080 0.8420 8.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -0.2940 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -1.2830 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 -1.8890 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 0.9320 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 0.2260 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.9100 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 2.2860 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 3.2570 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 1.5260 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -0.1600 8.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9220 1.1520 9.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 1.4000 8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 3.0070 4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 3.1160 4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4390 2.4730 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -0.0920 4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 1.5680 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 0.7720 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.2860 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -1.6510 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.8010 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 40 1 0 0 0 0 10 14 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 21 1 0 0 0 0 17 29 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 37 85 1 0 0 0 0 37 86 1 0 0 0 0 37 87 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 38 90 1 0 0 0 0 M END > 387 $$$$ 388 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 68 0 0 1 0 0 0 0 0999 V2000 -0.1040 1.2280 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.2900 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -0.5910 0.7610 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3170 1.8160 -0.1730 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5310 1.4820 1.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4790 -0.2540 -0.2950 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6960 0.1370 0.4460 N 0 0 3 0 0 0 0 0 0 0 0 0 4.8800 0.0750 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 0.9690 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 1.7410 1.1820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5940 0.4260 1.9110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8300 0.0820 2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 1.3190 2.5810 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0500 2.9530 2.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0110 2.5040 3.1780 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2740 2.1780 4.4700 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7080 3.5210 4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 4.5180 3.8130 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8970 3.7050 2.6310 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4400 3.7770 6.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.2530 4.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 2.8440 3.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.0460 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 4.9590 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 3.7470 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 3.3460 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 4.4730 2.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 2.5060 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 0.9030 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.5250 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 1.4360 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.6650 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -0.6470 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.7920 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 2.8340 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 2.2770 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -1.0970 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 0.4200 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -0.9530 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 1.9730 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 1.0140 -2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 0.5580 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -0.1110 3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.8160 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 1.2060 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 3.7040 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 1.8150 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 5.3610 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 4.4100 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 3.0240 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 4.7410 6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 1.0690 5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -2.7090 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -2.2360 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.2310 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 5.3640 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 5.7300 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 3.6610 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 3.8240 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 2.6580 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 2.7970 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 1.4540 3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 23 1 0 0 0 0 4 10 1 0 0 0 0 4 29 1 0 0 0 0 4 35 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 15 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 48 1 0 0 0 0 19 22 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 22 26 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 M END > 388 $$$$ 389 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 64 0 0 1 0 0 0 0 0999 V2000 -1.4020 -2.8040 -1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 1.4860 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1410 1.4660 -2.3890 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2250 2.1630 -2.4310 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7520 2.3420 -1.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8660 3.6090 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 2.2110 -0.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 1.0670 -3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 1.4540 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 2.1580 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1880 1.6240 1.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5460 2.1570 1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 2.0700 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 1.4180 -1.2430 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0730 2.0840 -1.3500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2060 1.6780 -2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 2.5070 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 3.4330 -1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 3.6930 -0.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 0.0920 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -0.5160 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8210 -0.6210 -1.1300 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6140 -2.1160 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -2.7490 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.0160 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -2.7150 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -0.3720 -0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -0.4700 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.1180 -2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 0.7780 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -0.1940 -2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 0.9800 -4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.7550 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 3.1710 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 3.7340 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 4.3390 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 2.7500 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 1.2360 -4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 1.1670 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 1.8640 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.9240 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 0.3480 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 3.4820 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -0.1730 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.3340 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -0.2470 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -0.1730 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -3.8280 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -2.8680 1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -3.6790 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -2.1030 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -0.7320 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -0.0980 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -1.5590 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.0800 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 1.9170 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 0.1540 -4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 1.0150 -4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 2 22 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 35 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 6 10 1 0 0 0 0 6 19 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 30 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 15 18 1 0 0 0 0 16 31 1 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END > 389 $$$$ 390 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.8140 0.9910 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 0.2010 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -0.6380 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -1.4180 -3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.6140 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 0.1810 -2.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 3.0110 -1.1800 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5220 3.5270 -1.3520 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5600 4.8640 -0.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 5.2230 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 4.1420 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 0.8640 1.8300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0330 1.7060 -0.3930 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0540 1.9590 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 2.5110 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 1.1500 2.5500 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2000 2.4780 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 2.5900 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 1.3710 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 4.1740 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 6.3140 0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 3.3080 1.4900 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0970 4.3710 1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 0.9350 3.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -0.5580 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 5.4500 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 6.6410 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 5.4650 2.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.4350 -3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.0340 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 0.1570 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -1.5840 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -0.3960 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 2.8580 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 3.6440 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 1.0920 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.9510 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 2.9290 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 3.1110 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 2.3770 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 0.3080 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 1.8060 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 0.4490 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 1.2110 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 1.6660 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 5.0580 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 3.3150 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 3.8000 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -0.6120 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -1.2760 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -0.7920 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 6.3190 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 7.3670 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 7.1000 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 11 20 2 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 24 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END > 390 $$$$ 391 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.3760 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0060 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6820 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0210 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4070 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0870 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 2.1000 0.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.4470 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 4.0650 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 5.5650 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 3.4190 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.1890 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -2.6820 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -3.5000 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.3350 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 1.9020 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.5590 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.5090 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 5.9710 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 5.9830 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 5.8250 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -2.5450 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -2.5660 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -2.3600 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -3.8220 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -3.8540 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 2.0090 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 0.7010 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.7130 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 M END > 391 $$$$ 392 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 73 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 5.2450 -3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 4.1130 -4.1470 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2400 3.0950 -3.8600 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3570 4.5880 -1.7320 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1370 3.7260 -1.4920 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2570 3.5820 -2.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3790 2.3350 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.6090 -1.2870 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2880 2.0250 0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3400 4.3010 -0.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0520 3.5290 -0.0250 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7410 3.9940 1.4310 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1350 3.8700 2.0890 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1440 4.2620 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 3.1630 2.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 2.3750 2.3770 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1170 1.5090 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 2.2490 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7690 1.6880 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 1.6770 -2.2290 N 0 0 3 0 0 0 0 0 0 0 0 0 4.8360 0.3540 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -0.0800 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 3.8070 -1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 3.8350 3.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.9490 3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 0.8750 4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 3.8210 -5.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 3.9300 -0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 4.5030 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.5150 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -1.8440 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -0.5240 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 5.8820 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 5.8370 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 3.7180 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 5.3800 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 4.4730 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 2.5740 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 1.6770 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.5170 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 5.3430 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 5.0370 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 3.5290 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 5.2510 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 2.2340 2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 0.5830 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 1.1390 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 2.1400 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 0.9480 -3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 1.4490 -4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 0.3990 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 -0.3660 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -0.1260 -3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 0.6400 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -1.0640 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 4.3150 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 3.1340 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 4.2240 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 4.6580 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 0.6110 5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 0.0100 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 1.1840 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 3.5440 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 39 1 0 0 0 0 7 10 1 0 0 0 0 7 23 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 44 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 24 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 32 67 1 0 0 0 0 M END > 392 $$$$ 393 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.3760 1.7290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 0.2390 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.3430 0.7260 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1750 0.4200 0.8380 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9330 1.9210 0.9900 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9630 2.4450 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -0.1500 3.3620 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4540 1.6600 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 1.1800 4.3920 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5310 0.9780 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 0.3230 2.2100 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9140 -0.1350 2.0510 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0650 0.1880 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 0.8220 -0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 0.3690 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -0.4680 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.0130 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -1.8080 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 2.6480 0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 3.8890 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 4.3550 1.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 4.7000 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -1.4270 4.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -1.8800 4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -3.1970 5.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -1.2330 4.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -1.2270 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 0.0180 0.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -0.6600 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -0.1470 4.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -0.7420 5.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -1.6600 2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -2.5760 0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -3.8850 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.3740 -0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -4.7460 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 2.1400 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 1.8660 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -0.3560 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 2.1460 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.3100 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.5180 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -0.0620 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 2.4210 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4790 2.0460 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 1.8960 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 1.9030 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 0.7400 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -0.8690 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.6470 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 0.0530 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -1.4990 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.4550 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 0.5670 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -1.0740 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 0.2880 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -1.8640 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -2.2160 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 4.1180 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 5.6150 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 4.9520 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -3.6310 5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -3.0340 6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -3.8770 5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -0.2730 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -1.6920 5.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -4.1340 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -5.1860 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -5.5380 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 40 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 23 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 46 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 15 28 2 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 33 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 29 30 1 0 0 0 0 29 32 2 0 0 0 0 30 31 2 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 M END > 393 $$$$ 394 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0250 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.4500 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.0460 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 4.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 1.2530 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -0.7160 -0.0360 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6500 -4.4040 -1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -4.9040 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 -5.9620 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 -6.5200 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -6.0150 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -4.9580 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -7.5600 0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -6.4560 -2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0590 -5.8340 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 -8.0820 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -3.2480 -2.1540 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3730 -1.9140 -1.5140 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0800 -1.0680 -1.4780 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0100 -1.9920 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -3.3310 -1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4350 -1.2310 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -1.9150 0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 -2.0300 -2.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7490 -2.0800 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -0.1640 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -1.5670 -3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.5280 -3.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9760 -2.3430 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.9560 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 5.1900 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 3.8190 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 3.8280 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 1.9070 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 0.6290 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 0.6200 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -0.0850 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 -4.4690 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -6.4460 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -4.5650 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 -5.9270 -4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -4.7790 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 -6.3220 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -7.2960 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -8.4430 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 -8.9050 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -3.2360 -3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -1.8630 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -1.7870 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -1.1340 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -0.2420 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -2.5240 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -3.2450 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1990 -2.6180 -4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7840 -1.7270 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 24 1 0 0 0 0 11 28 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 27 29 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 M END > 394 $$$$ 395 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3440 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.8300 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 2.2110 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4180 1.3600 -0.4010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4470 0.0560 0.4020 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7430 -0.6890 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -1.0310 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 0.2520 -2.2740 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3680 1.0300 -1.8920 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2640 -0.4400 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 0.6130 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 1.7420 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 2.1460 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 2.3260 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -0.0810 -3.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.2700 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 3.1560 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 2.7600 1.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 3.9400 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 4.4950 0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 4.5710 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -1.6610 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -1.2130 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 3.0230 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -0.0530 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -1.6070 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -1.5690 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -1.6590 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 0.8690 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 0.4220 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 0.5620 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 2.3820 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 1.5460 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.0710 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 2.9300 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 2.0890 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 2.8830 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -0.5710 -3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 3.4890 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 3.8090 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 3.1930 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 3.9300 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 5.5450 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 4.6960 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 30 1 0 0 0 0 10 15 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 18 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 M END > 395 $$$$ 396 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 76 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 2.1210 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 2.1580 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 8.8970 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 8.6770 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 7.2290 2.5370 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2530 7.9650 0.3220 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4500 6.5150 0.6860 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8380 6.2620 2.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5320 4.8680 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 4.5450 0.6510 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6360 3.6460 0.1670 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2040 5.7090 0.3640 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3540 4.2260 0.7560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1340 3.6020 0.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2730 4.2350 -1.3800 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8490 5.6600 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 7.0610 4.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 2.3120 0.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 6.2630 1.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 8.0840 -1.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 6.8750 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 5.9210 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8470 6.7490 0.2660 N 0 0 3 0 0 0 0 0 0 0 0 0 -7.0090 6.3730 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 7.5120 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 3.6000 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 3.4520 -2.0960 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0470 2.0760 -2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 9.0920 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 1.4790 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 4.2600 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.3530 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.3790 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -0.3700 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 8.7210 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 9.9340 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 8.8810 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 9.3400 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 8.3040 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 6.3130 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 4.1120 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 4.8650 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 4.0710 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 4.0800 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.9360 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 5.8210 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 6.4080 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 7.7300 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 6.0300 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 7.3030 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 1.8990 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 5.8030 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 5.9530 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9350 7.6740 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 5.8750 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 6.1850 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 5.4720 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8940 7.2330 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3500 7.7000 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 8.4130 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 2.7200 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 4.4500 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 3.8870 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 10.0610 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 8.8640 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 9.1180 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 0.4350 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 1.5360 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 2.0110 -4.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 10 1 0 0 0 0 7 19 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 45 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 33 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 22 31 1 0 0 0 0 23 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 65 1 0 0 0 0 30 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 M END > 396 $$$$ 397 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1480 1.4840 -1.2250 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0850 -0.0450 -1.1850 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7200 -0.4630 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7130 -0.5780 -2.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.0030 -2.3620 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2550 -4.3810 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -3.6530 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -2.4200 -1.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -3.9100 -3.6840 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3760 -2.4460 -3.6990 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2700 -2.4080 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -3.6110 -4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -4.6420 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -1.1540 -5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.4960 -6.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.4840 -7.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 0.6500 -6.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -5.6740 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.5340 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.9580 0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 3.4770 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 1.9070 -1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -1.7980 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -4.0680 -4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.9890 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -6.0920 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -6.4410 -3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -7.7340 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -0.7620 -7.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.7280 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.8460 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.4070 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.3660 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -2.4220 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -4.0710 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -3.8380 -5.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -5.5080 -4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -4.9440 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.4770 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -0.6680 -5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -0.1110 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.2460 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -2.3630 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 3.8760 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 1.5850 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 2.9520 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -8.3160 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 -8.2460 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 -7.6270 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -0.7180 -7.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.0140 -8.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -1.7530 -8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 28 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 21 29 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 28 50 1 0 0 0 0 30 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END > 397 $$$$ 398 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.5020 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0300 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5690 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0420 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.6160 -1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9770 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8650 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 5.4580 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9940 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.6080 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 -2.0520 -5.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -3.3290 -5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -4.2990 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -3.9090 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -5.7100 -5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -4.7330 -2.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -1.5790 -4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -2.4620 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -1.9710 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -0.6050 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 0.2690 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -0.2120 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -6.4190 -5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -7.7310 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -8.3440 -6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -7.6400 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -6.3300 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -2.8280 -0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -9.6360 -6.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9330 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 3.6390 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 4.0010 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 1.6100 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5450 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 4.8180 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8600 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7360 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -3.6050 -6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -0.2170 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 0.4790 -4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6470 -5.9420 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -8.2810 -6.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -8.1200 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -5.7830 -4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 -3.0580 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -10.2820 -5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.5380 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -2.4830 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.4740 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 20 1 0 0 0 0 17 25 1 0 0 0 0 17 29 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M END > 398 $$$$ 399 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 52 0 0 1 0 0 0 0 0999 V2000 -0.1790 1.1510 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.2130 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.7260 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.1170 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 1.4710 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 1.9890 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 2.3840 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 2.4800 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 3.3940 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 3.6580 -2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 4.4900 -2.5110 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1040 -1.0400 -0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 1.6580 -1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 3.0660 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 3.9140 -0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 5.7350 -1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 6.7820 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 6.6380 -3.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 8.1370 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 3.7050 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 4.4820 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2830 3.6980 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5710 4.4750 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4340 3.6910 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -1.7830 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -0.2840 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 3.0470 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 3.3760 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 1.9850 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 1.4880 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 2.8790 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 2.7100 -3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 4.2040 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8520 4.7060 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -1.4100 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 3.5980 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 3.3360 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 3.3380 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 8.6830 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 8.6940 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 8.0150 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 3.5660 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 2.7320 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9710 4.6220 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 5.4550 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7330 3.5590 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5310 2.7250 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1220 4.6140 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3230 5.4480 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3510 4.2440 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 3.5520 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6820 2.7180 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 16 1 0 0 0 0 11 20 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 M END > 399 $$$$ 400 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.0190 1.4950 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.1630 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.2950 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.9370 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 1.9680 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 -1.2840 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0260 -2.5400 -0.8700 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7270 -3.2460 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9230 -1.6770 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -2.3840 -2.5440 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9550 -3.6390 -1.7340 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6570 -4.3460 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -3.4030 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -1.4410 -1.6990 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4700 -2.1470 -1.3050 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6110 0.7570 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -0.2020 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 0.1150 -1.2070 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5530 -1.2390 -0.5240 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1350 -0.8450 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 0.3900 1.2520 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7390 0.9900 -0.0520 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5640 -4.3120 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 -2.7800 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8240 -3.4210 -1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -0.0180 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -1.9020 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -0.0120 2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 2.2010 -0.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 0.0110 3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.3550 3.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -0.3930 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -2.4470 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3140 -1.1510 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -0.7550 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -1.0060 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 2.9950 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0860 -0.6120 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6200 -0.7800 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5760 -2.2600 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9620 -4.1400 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1180 -2.5730 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 -0.7820 -3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 -2.3480 -3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 -4.6300 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 -5.2400 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -3.9070 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -3.1210 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 1.0140 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 1.6640 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 0.2870 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -0.4970 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -1.6520 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 -0.5820 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 1.1200 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 2.0190 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -3.4520 -4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -3.2840 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -1.8860 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6640 -3.0390 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -0.5420 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -0.5820 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 0.9740 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -2.7360 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -1.4640 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 0.1520 5.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -0.1580 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 29 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 40 1 0 0 0 0 8 11 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 M END > 400 $$$$ 401 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 4.2420 -0.1240 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1720 5.7560 -0.0520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4640 6.0950 1.2630 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1520 5.3100 1.3440 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4280 3.9120 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 3.5290 0.0110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9900 3.9060 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 6.4280 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 7.4960 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 5.5780 2.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 4.9250 5.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 6.0790 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 4.6970 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 5.2610 3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 5.0400 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 4.2660 1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 3.7170 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 3.9270 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 6.3080 6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 5.7460 6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 5.9670 7.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 6.7370 8.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 7.2920 8.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 7.0840 7.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 6.5640 4.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 6.9720 9.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 4.4430 5.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 7.6310 7.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.0780 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.3980 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -1.4070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.7250 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 1.7340 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 3.9330 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 6.0740 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 5.8230 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 5.6120 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 3.8080 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 4.3280 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 7.3920 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 7.7820 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 4.0950 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 3.1180 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 3.4920 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 5.5380 7.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 7.8900 9.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 6.1870 10.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 7.9410 10.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 6.9600 9.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 7.0660 7.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 5 11 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 16 32 2 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 17 30 2 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 33 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 33 55 1 0 0 0 0 M END > 401 $$$$ 402 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4180 2.0560 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3890 3.5860 0.0690 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6210 4.0150 1.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7850 3.4090 1.2820 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6860 1.9870 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 5.4760 1.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.4980 -0.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 1.6440 -1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 6.1110 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 7.6140 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 5.4720 3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 4.0860 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 3.9150 0.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 1.6620 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 3.9820 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.6620 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 3.6760 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.3550 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.3660 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 5.9870 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -1.4630 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 0.6850 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 8.0090 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 7.9030 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 8.0160 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 3.8460 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 3.5730 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 5 20 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 11 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 M END > 402 $$$$ 403 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 89 0 0 1 0 0 0 0 0999 V2000 1.6850 2.7200 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 1.4350 0.1370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1470 0.3610 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 2.4280 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 1.4500 1.8230 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6130 0.1720 1.5320 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8570 -0.8350 2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -1.2640 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 1.0940 1.8520 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2480 -0.0660 2.7690 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1810 1.9860 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 2.2720 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 0.7320 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -0.4610 2.5530 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1320 -1.5280 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 -1.7290 3.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1180 0.5780 2.7850 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3540 -0.4190 3.9180 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8530 -0.6480 4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5060 -1.1220 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2830 -0.1080 1.7010 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7810 0.1080 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 3.4020 2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5230 1.5560 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7930 0.1620 5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 2.1340 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 1.7190 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 0.3950 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -1.0850 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 0.8220 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -0.2700 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.6650 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.9610 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8820 -0.6720 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 2.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 2.3890 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 2.1540 -2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9600 1.1980 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2890 1.2360 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3080 2.2110 2.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 3.4440 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 3.1610 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 1.0580 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 1.9770 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 3.3560 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -0.4200 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.7260 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -1.9990 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -1.7450 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 2.8020 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -1.3510 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 -2.4870 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 -2.4710 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -2.1070 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3160 0.2750 4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9850 -1.4120 4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5790 -1.2490 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0810 -2.0840 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3510 -0.8420 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 0.8560 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9500 -0.5480 6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3030 1.0970 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 0.3490 5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 2.6530 2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 1.3870 3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 2.8530 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 -0.4050 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 1.2780 4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 0.6380 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -0.3190 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -1.5000 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -1.8780 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 0.5730 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.0410 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 1.6800 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -1.1970 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -1.7680 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -0.8480 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3910 -1.6130 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7300 0.0420 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9490 -0.8440 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 2.2680 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 3.4160 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 1.7070 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6790 2.0980 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 50 1 0 0 0 0 12 23 2 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 38 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 35 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 85 1 0 0 0 0 M END > 403 $$$$ 404 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 3.2480 -2.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 2.4800 -1.4130 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0000 3.3350 -1.4010 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1500 4.5450 -2.3880 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7010 4.4670 -2.4060 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0520 4.0340 -3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 4.2040 -4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 4.7830 -3.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 3.9340 -5.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 2.1140 0.0200 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2030 3.3240 0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 3.2290 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 4.4440 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 2.1680 2.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 1.5720 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 3.8720 -0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 5.4090 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 5.3330 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 1.4760 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 2.7470 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 5.8490 -4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 4.2570 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 5.3000 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 4.6530 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 4.2560 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 4.4200 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 22 37 1 0 0 0 0 M END > 404 $$$$ 405 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1820 -0.0230 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0590 2.5440 1.4120 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3740 3.3270 1.4040 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3960 2.5580 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 3.1740 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 3.8910 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 4.0780 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8370 3.5670 2.8420 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2740 3.1350 -0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 4.2830 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 3.3970 -0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 1.3490 2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 2.3410 3.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 3.3220 -2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 2.2760 -2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 4.5420 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 1.5700 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 3.1560 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0860 4.2640 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 4.6100 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 4.3010 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 0.7550 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 2.4160 4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 5.0900 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 4.2360 -3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 5.1830 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 32 1 0 0 0 0 17 20 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M END > 405 $$$$ ATCMD MOE2008 3D 46 50 0 0 1 0 0 0 0 0999 V2000 2.5290 0.6190 1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 0.4250 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -0.7280 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -1.6740 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -0.5890 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -0.7620 4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 1.1740 2.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 1.9810 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 2.6000 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 0.3530 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -0.2590 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 0.4020 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 1.7710 -2.2410 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3630 1.7030 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 2.5520 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 3.6360 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -0.2020 -0.7560 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0790 0.4990 0.3870 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2600 -2.3060 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -2.1710 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -3.3630 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.6460 -0.5390 N 0 0 1 0 0 0 0 0 0 0 0 0 -1.5530 -1.5270 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.2370 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 0.3570 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 1.2620 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -2.0800 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -2.9850 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -1.4200 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -0.2650 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 0.1830 1.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -0.8000 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -0.2900 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 -1.2780 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -1.8220 -0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 2.5430 -3.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 2.2290 -4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 2.4090 -4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 1.1920 -4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 2.8830 -4.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -0.3020 1.3970 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9850 -0.6490 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -1.7420 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -2.6230 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -1.5170 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.7530 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 46 1 0 0 0 0 18 24 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M END > 406 $$$$ 407 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3950 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0280 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.0420 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.7640 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.2080 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -0.7920 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -0.2520 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 2.0600 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4190 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.1000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.6060 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 4.1710 0.4350 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5720 3.4590 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 2.0780 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 5.5970 0.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -4.2670 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 6.4140 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 7.9070 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 5.9530 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 3.5980 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 4.0780 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -0.4920 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -2.8320 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 2.2480 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 3.9630 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 3.9400 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 3.9910 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -4.5560 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -4.6720 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -4.6610 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 8.1640 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 8.4020 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 8.2350 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 4.6540 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 3.0910 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 3.1470 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1410 3.9690 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 3.5700 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 5.1360 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 1 12 2 0 0 0 0 2 4 1 0 0 0 0 2 11 2 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 17 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END > 407 $$$$ 408 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -0.0480 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.3390 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 2.0490 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.5560 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 4.1390 0.1200 N 0 0 2 0 0 0 0 0 0 0 0 0 3.6870 2.1120 0.0260 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4570 3.4120 -0.7820 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7940 4.1530 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 3.3160 -1.6780 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7970 1.8940 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 1.3680 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.7150 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -2.0390 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -2.1470 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -0.8890 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 2.6400 1.4670 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0560 3.9490 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 3.8810 -1.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 2.9080 1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9360 3.7250 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3340 4.2860 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 3.1360 -3.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.9270 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.5870 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 3.8900 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 3.9100 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 3.2230 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 5.1220 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 4.2950 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 3.3380 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 1.2710 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 0.3300 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -2.2740 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -2.9750 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 1.9290 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 4.7870 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 3.8630 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 3.2420 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 4.7790 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0550 3.4760 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4700 5.0070 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 13 2 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 14 2 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END > 408 $$$$ 409 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0910 1.4080 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.0210 -0.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6110 -0.5440 1.2220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0330 0.0220 1.2780 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9640 1.5520 1.2440 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2120 1.9930 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5300 -0.5330 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.1420 -1.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9710 1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -0.4020 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 2.0890 1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 3.4180 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 3.9440 -1.2140 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3620 3.6820 -2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 4.3510 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 5.4700 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 5.4510 -1.0650 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6850 6.1360 -0.8750 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4680 7.5720 -1.3980 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2670 7.5170 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 6.0480 -2.3910 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0680 6.1340 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 8.4520 -0.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 5.9800 -2.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 5.3170 -3.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 5.6780 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 6.5340 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 6.5010 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 7.0580 -4.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.3730 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.2250 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -0.3360 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 1.9120 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 1.6670 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -1.6200 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.1090 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -0.4330 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -2.3710 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -0.0790 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 3.0550 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 3.4710 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 3.9420 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 5.9440 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 7.9130 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 8.1570 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 7.8360 -3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 6.5870 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 9.3710 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 5.4290 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 4.2590 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 5.7420 -4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 7.3890 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 6.4800 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 5.6090 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 33 1 0 0 0 0 6 12 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 27 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END > 409 $$$$ 410 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 70 73 0 0 1 0 0 0 0 0999 V2000 -0.0780 1.3450 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.0530 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.7380 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.0450 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 1.3390 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.0380 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 2.0840 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 10.1280 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 8.6930 -4.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 12.1120 -3.9980 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9520 12.5570 -3.5640 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3070 11.8720 -2.2410 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2090 10.3540 -2.4190 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8910 10.0110 -2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 10.5850 -4.1080 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2400 12.6880 -5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 13.9750 -3.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 12.2230 -1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 9.7100 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 8.2840 -1.2550 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6320 7.8880 -2.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 8.1090 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 8.2460 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 7.6990 0.1430 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0380 8.1800 0.7510 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4140 7.0780 1.7650 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6760 5.8020 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 6.1680 0.0540 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6100 5.5160 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 7.4580 3.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 9.4470 1.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 7.9670 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 5.7930 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 4.1670 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 3.4330 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 3.5610 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 8.1300 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 6.6450 -5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 8.8140 -5.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.5950 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -1.8180 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -0.5870 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 1.8730 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.1180 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 1.5460 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 10.3720 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 10.6360 -5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 12.4380 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 12.2740 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 12.1930 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 10.0280 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 10.2620 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 13.6550 -5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 14.3270 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9310 11.8230 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 7.9140 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 8.1740 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 8.4180 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 6.9100 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 5.4760 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 5.0130 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 6.8060 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 9.7740 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 6.2510 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 6.1520 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 4.7090 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 3.9710 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 6.4390 -6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 6.2860 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 6.1360 -4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 44 1 0 0 0 0 7 35 2 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 17 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 57 1 0 0 0 0 23 25 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 32 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 34 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 67 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 38 70 1 0 0 0 0 M END > 410 $$$$ 411 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 146153 0 0 1 0 0 0 0 0999 V2000 0.1860 -0.3120 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -1.5880 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -2.4040 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.0830 -0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 10.7400 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 10.7100 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 11.7830 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 9.8240 2.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 9.4970 -1.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 9.6740 0.6580 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9780 10.1940 -0.3300 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9080 9.0420 -0.7230 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0730 7.9000 -1.3090 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0970 7.4850 -0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 8.5080 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 6.7990 -1.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 11.2340 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 5.7190 -2.2860 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8460 4.6680 -1.2530 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2060 3.4800 -1.9760 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1330 2.9460 -2.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 3.8710 -3.9420 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2150 5.0750 -3.2980 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9960 4.2240 -0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 3.1850 -4.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 6.0270 -4.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 3.9140 -2.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 1.6410 -2.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5600 0.5560 -2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 0.1060 -4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.2510 -5.0050 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6460 2.4450 -4.5390 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2020 2.8470 -3.1290 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8750 1.9920 -0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 3.5430 -5.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 1.6340 -5.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 4.0090 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 2.4890 -0.8660 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2120 1.8580 0.3130 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8700 4.5510 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 4.0360 0.5680 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5520 2.5140 0.5510 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2650 1.9860 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 2.3570 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 4.5120 0.5390 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9270 3.8670 1.5740 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5390 6.4640 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 6.0340 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 5.6710 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3870 4.2050 1.2240 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3260 3.7210 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7380 4.2810 2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9220 6.3150 0.9470 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7130 5.8050 2.1480 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1340 6.3650 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8410 6.0440 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0560 6.5960 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6410 6.0170 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 4.6090 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 4.4640 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 6.2920 3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 5.9680 4.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 6.9720 3.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0080 8.1220 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7580 6.1650 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 1.8550 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 0.3780 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 3.4490 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 7.4040 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 4.2590 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 2.2180 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -1.8240 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -2.6620 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -3.3170 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 12.7560 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 11.5940 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 11.7760 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 8.8180 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 9.3320 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 10.5810 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 8.6870 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 8.2430 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 8.8590 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 8.1060 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4240 11.6100 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 6.0940 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 5.1030 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 2.7100 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 4.2070 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1200 4.7440 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 3.5560 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 2.7800 -4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 3.9110 -5.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 2.3760 -5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 5.7150 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 1.3420 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -0.7310 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2130 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 0.9230 -5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 2.1670 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 3.1720 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 3.3560 -6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 0.9240 -5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 4.4100 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 4.3300 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 2.1940 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 4.2170 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 5.6400 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 2.4040 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 0.8970 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 1.9780 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 1.8430 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 7.5010 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 6.4930 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 6.4020 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 3.9390 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 2.6200 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3690 3.9280 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1610 3.9240 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 7.4420 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6940 5.9130 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8410 6.4870 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9430 4.9610 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7270 4.9390 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 6.4440 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 4.4200 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 4.1320 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 5.6830 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 4.1470 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 5.5520 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 4.1160 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0950 6.3020 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0230 8.5180 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 8.4960 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5220 8.4400 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7900 5.0770 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2080 6.5530 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7740 6.5600 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.2790 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 1.4060 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.8800 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -0.1010 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 0.3330 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 3.8370 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 3.5840 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 2.3880 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 67 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 72 1 0 0 0 0 3 73 1 0 0 0 0 3 74 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 75 1 0 0 0 0 7 76 1 0 0 0 0 7 77 1 0 0 0 0 9 12 1 0 0 0 0 9 78 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 79 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 80 1 0 0 0 0 12 13 1 0 0 0 0 12 81 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 82 1 0 0 0 0 14 15 1 0 0 0 0 15 83 1 0 0 0 0 15 84 1 0 0 0 0 16 18 1 0 0 0 0 17 85 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 86 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 87 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 88 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 89 1 0 0 0 0 23 26 1 0 0 0 0 23 90 1 0 0 0 0 24 91 1 0 0 0 0 25 92 1 0 0 0 0 25 93 1 0 0 0 0 25 94 1 0 0 0 0 26 95 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 34 1 0 0 0 0 28 96 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 97 1 0 0 0 0 30 98 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 31 99 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 32100 1 0 0 0 0 33101 1 0 0 0 0 34 38 1 0 0 0 0 35102 1 0 0 0 0 36103 1 0 0 0 0 37 38 1 0 0 0 0 37 40 1 0 0 0 0 37104 1 0 0 0 0 37105 1 0 0 0 0 38 39 1 0 0 0 0 38106 1 0 0 0 0 39 42 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 40 41 1 0 0 0 0 40107 1 0 0 0 0 40108 1 0 0 0 0 41 42 1 0 0 0 0 41 45 1 0 0 0 0 41 59 1 0 0 0 0 42 43 1 0 0 0 0 42 71 1 0 0 0 0 43 44 1 0 0 0 0 43109 1 0 0 0 0 43110 1 0 0 0 0 44 46 1 0 0 0 0 44111 1 0 0 0 0 44112 1 0 0 0 0 45 46 1 0 0 0 0 45 48 1 0 0 0 0 45 70 1 0 0 0 0 46 50 1 0 0 0 0 46 60 1 0 0 0 0 47 48 1 0 0 0 0 47 49 2 0 0 0 0 47113 1 0 0 0 0 48114 1 0 0 0 0 48115 1 0 0 0 0 49 50 1 0 0 0 0 49 53 1 0 0 0 0 50 51 1 0 0 0 0 50 68 1 0 0 0 0 51 52 1 0 0 0 0 51116 1 0 0 0 0 51117 1 0 0 0 0 52 54 1 0 0 0 0 52118 1 0 0 0 0 52119 1 0 0 0 0 53 54 1 0 0 0 0 53 58 1 0 0 0 0 53 69 1 0 0 0 0 54 55 1 0 0 0 0 54 61 1 0 0 0 0 55 56 1 0 0 0 0 55120 1 0 0 0 0 55121 1 0 0 0 0 56 57 1 0 0 0 0 56122 1 0 0 0 0 56123 1 0 0 0 0 57 58 1 0 0 0 0 57 64 1 0 0 0 0 57 65 1 0 0 0 0 58124 1 0 0 0 0 58125 1 0 0 0 0 59126 1 0 0 0 0 59127 1 0 0 0 0 59128 1 0 0 0 0 60129 1 0 0 0 0 60130 1 0 0 0 0 60131 1 0 0 0 0 61 62 1 0 0 0 0 61 63 2 0 0 0 0 62132 1 0 0 0 0 64133 1 0 0 0 0 64134 1 0 0 0 0 64135 1 0 0 0 0 65136 1 0 0 0 0 65137 1 0 0 0 0 65138 1 0 0 0 0 66139 1 0 0 0 0 66140 1 0 0 0 0 66141 1 0 0 0 0 67142 1 0 0 0 0 67143 1 0 0 0 0 68144 1 0 0 0 0 68145 1 0 0 0 0 68146 1 0 0 0 0 M END > 411 $$$$ 412 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 4.2420 -0.1240 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1720 5.7560 -0.0520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4640 6.0950 1.2630 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1520 5.3100 1.3440 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4280 3.9120 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 3.5290 0.0110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9900 3.9060 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 6.4280 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 7.4960 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 5.5780 2.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 6.5050 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 5.8350 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 5.9490 3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 6.7350 4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 7.4070 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 7.2900 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 4.9810 2.7260 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2450 4.9020 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 3.6380 3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 6.8490 3.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 2.6020 3.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.9560 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -1.7280 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -0.1990 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.7250 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 1.7340 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 3.9330 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 6.0740 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 5.8230 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 5.6120 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 3.8080 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 4.3280 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 7.3920 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 7.7820 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 6.4110 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 5.4260 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 8.0200 5.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 7.8120 6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 6.1840 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 5 11 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 26 3 0 0 0 0 25 44 1 0 0 0 0 M END > 412 $$$$ 413 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 16 15 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6620 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -2.6670 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -4.1180 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.6240 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0630 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -2.6310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -4.4650 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -4.4560 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -4.5200 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -0.4950 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 8 16 1 0 0 0 0 M END > 413 $$$$ 414 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 106113 0 0 1 0 0 0 0 0999 V2000 -4.0090 4.3260 -0.2150 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8220 2.9670 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 2.7940 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 3.5430 -2.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4980 5.0220 -2.0760 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7610 5.1370 -0.5710 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2280 4.3830 1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 6.5090 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 5.7160 -2.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 2.9900 -1.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 2.2790 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 3.7490 1.6230 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9830 4.4700 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 2.1970 2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 2.9420 4.2660 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0620 4.3380 4.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6850 4.9200 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 3.9660 6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 2.1300 5.5080 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7720 2.7270 6.5790 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0320 -0.1910 6.5610 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9920 0.6190 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 0.4860 7.6710 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6610 1.6580 7.1520 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4440 2.0630 8.4230 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8270 -0.3270 8.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6260 0.7440 9.1900 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9680 0.2950 9.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5960 -0.3030 11.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7110 -1.4500 10.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 -1.4970 9.2350 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0710 0.8940 10.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0370 -0.3240 10.6320 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.6310 -1.7230 10.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4100 -2.4350 11.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1320 -1.6270 10.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9860 -2.4750 9.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 2.5970 8.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6950 1.1960 6.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 1.0000 8.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -0.4370 6.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 2.7710 5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 5.9610 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3870 3.9390 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -0.1840 12.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6670 0.3060 11.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 -2.7580 8.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4800 -3.6920 9.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3490 -4.1610 9.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9510 -4.4750 8.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 4.7420 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 1.7320 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 3.1890 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 3.4480 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 5.4570 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 4.7480 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 6.6550 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 5.6790 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 2.0520 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 1.7880 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 1.7680 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 3.8160 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 1.1550 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 2.6630 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 4.9780 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 5.3040 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 5.7870 5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7920 4.5040 7.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4300 3.7100 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 3.0820 7.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -1.1600 6.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 0.3950 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 0.2940 4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8780 2.7820 9.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -0.7410 7.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -1.3620 11.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -2.4040 11.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.6100 9.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8940 -1.8710 12.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8360 -3.4370 11.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 -2.5030 12.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2870 -1.2190 9.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5780 -2.6200 10.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5990 -0.9730 11.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2880 2.8090 8.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1850 0.8940 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 0.3510 6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 2.0150 5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 1.7150 8.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 1.4860 9.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 0.1610 9.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -0.8730 6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 2.1140 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 3.6420 6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 6.0710 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4950 6.5170 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 6.3500 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 2.8660 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 4.4440 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 4.1280 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -3.1910 7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2230 -3.4810 9.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9770 -2.4990 8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1160 -5.0960 8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7430 -5.1090 7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6130 -3.7860 7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 55 1 0 0 0 0 6 8 1 0 0 0 0 6 56 1 0 0 0 0 7 12 1 0 0 0 0 8 57 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 60 1 0 0 0 0 11 61 1 0 0 0 0 12 13 1 0 0 0 0 12 62 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 63 1 0 0 0 0 14 64 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 66 1 0 0 0 0 17 67 1 0 0 0 0 18 20 1 0 0 0 0 18 68 1 0 0 0 0 18 69 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 20 24 1 0 0 0 0 20 70 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 21 71 1 0 0 0 0 22 72 1 0 0 0 0 22 73 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 25 74 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 75 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 47 1 0 0 0 0 31 78 1 0 0 0 0 33 34 1 0 0 0 0 33 46 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 37 48 1 0 0 0 0 38 85 1 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 39 88 1 0 0 0 0 40 89 1 0 0 0 0 40 90 1 0 0 0 0 40 91 1 0 0 0 0 41 92 1 0 0 0 0 42 93 1 0 0 0 0 42 94 1 0 0 0 0 43 95 1 0 0 0 0 43 96 1 0 0 0 0 43 97 1 0 0 0 0 44 98 1 0 0 0 0 44 99 1 0 0 0 0 44100 1 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 48 49 2 0 0 0 0 48 50 1 0 0 0 0 50104 1 0 0 0 0 50105 1 0 0 0 0 50106 1 0 0 0 0 M END > 414 $$$$ 415 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7200 -0.4630 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.0450 -1.1850 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1480 1.4840 -1.2250 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2750 3.5230 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 3.3290 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 3.6000 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 4.0560 -5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 4.2480 -5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 3.9800 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 2.8430 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 2.6560 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 2.1870 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.0010 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 1.9520 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.4780 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -0.6150 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 3.5000 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 4.1440 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 1.9070 -1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 4.6980 -6.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 5.6490 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 3.5160 1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.4070 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.8460 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.7280 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 3.3110 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 3.4530 -4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 4.2660 -6.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0610 4.1310 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 2.6340 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 2.8650 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.4420 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -0.2520 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -0.2960 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -1.7040 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 1.5810 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 3.9950 -6.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 6.0360 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 6.0330 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 5.9680 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 16 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 29 1 0 0 0 0 6 20 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 21 25 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END > 415 $$$$ 416 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.4000 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6840 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 2.0970 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0240 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.4330 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 0.6100 -0.4060 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8180 1.8970 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 2.0680 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 0.5340 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 0.5150 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 0.4860 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7570 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.1690 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -2.2590 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 0.4410 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.7640 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.1770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 0.5590 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 2.6760 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 2.2470 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 2.2640 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 1.4240 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -0.3530 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 0.4320 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 0.5000 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -2.5970 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -2.7020 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -2.5630 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 0.4240 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 6 2 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 17 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 M END > 416 $$$$ 417 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.4000 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6840 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0970 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0240 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.4330 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 0.6120 0.4170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8180 1.8970 0.0170 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1970 2.0680 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 0.5480 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 0.5380 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 0.5020 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7570 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.1700 0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -2.2590 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 2.3480 -1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 3.7640 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 0.4750 4.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.7640 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.1770 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 0.5550 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.6810 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 2.2640 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 1.4480 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -0.3300 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 0.4560 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 0.5090 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.5970 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -2.7020 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -2.5640 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 4.0860 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 4.2600 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 4.0260 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.4650 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 6 2 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 22 1 0 0 0 0 9 17 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 19 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END > 417 $$$$ 418 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.4000 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6840 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 2.0970 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0240 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.4330 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 0.6100 -0.4060 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8180 1.8970 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 2.0680 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 0.5340 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 0.5150 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 0.4860 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7570 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.1690 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -2.2590 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.7640 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.1770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 0.5590 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 2.6760 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 2.2470 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 2.2640 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -0.5160 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 0.9780 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 1.0680 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 0.5000 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 0.4320 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -2.5970 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -2.7020 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -2.5630 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 6 2 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 M END > 418 $$$$ 419 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.4000 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6840 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0970 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0240 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.4330 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 0.6120 0.4170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8180 1.8970 0.0170 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1970 2.0680 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 0.5480 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 0.5380 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 0.5020 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7570 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.1700 0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -2.2590 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 2.3480 -1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 3.7640 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.7640 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.1770 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 0.5550 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.6810 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 2.2640 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -0.4910 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 1.0090 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 1.0890 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 0.5090 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 0.4560 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.5970 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -2.7020 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -2.5640 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 4.0860 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 4.2600 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 4.0260 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 6 2 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 17 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 M END > 419 $$$$ 420 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -2.1220 -2.7740 0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.5130 0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4050 3.8060 -1.7780 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5230 2.6580 -2.1720 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1230 2.0650 -0.9060 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2060 2.9340 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 3.0930 -0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 1.6810 -2.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 2.2030 0.0330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4140 1.2440 0.2480 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7040 1.8940 0.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 2.9030 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 3.3800 -1.5390 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5280 3.3550 -0.8850 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2740 4.7320 -1.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 3.4600 -0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 4.2020 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 0.0690 -0.7180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0460 -0.5000 -0.9860 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3590 -0.6080 -0.4030 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2290 -2.1140 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.7420 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -1.9950 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.7010 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -0.1360 0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.5390 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 4.4750 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -0.1450 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 0.4740 -1.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 0.3140 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 0.7110 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -0.1480 -1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 1.7410 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 4.5480 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 3.0570 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 1.2960 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 2.2010 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 3.4930 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 3.6220 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 3.5030 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.9260 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.8310 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 2.7690 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 4.8060 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -0.7100 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.3610 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -3.8170 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -2.9340 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -3.6250 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -2.0560 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -0.4760 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -0.1250 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -1.6260 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -0.2450 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 3.7720 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 4.7770 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 5.3530 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 1.1050 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 1.4770 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -0.1610 -3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 5 1 0 0 0 0 2 9 1 0 0 0 0 2 20 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 28 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 36 1 0 0 0 0 5 7 1 0 0 0 0 5 37 1 0 0 0 0 6 9 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 14 17 1 0 0 0 0 15 45 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 M END > 420 $$$$ 421 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -0.1840 1.4470 -0.1920 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7240 -0.4210 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 0.3260 -0.5980 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9740 -0.2520 0.7540 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7170 0.5460 1.8440 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2040 0.3010 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 0.3810 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 0.3880 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -0.0850 0.8860 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6640 -0.5880 -0.3020 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2140 -0.0740 -0.1670 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3860 -0.6320 1.1190 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4180 -0.2400 2.3490 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9010 -0.5940 2.2010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8370 -0.1660 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.5780 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.6790 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4990 0.4760 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 1.3660 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 0.0480 2.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 0.0640 3.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -1.7050 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 1.0280 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -2.1220 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 1.9260 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 2.0010 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 1.2900 -1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -0.1140 -1.6410 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9030 3.1630 -1.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.1350 2.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -1.9920 2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 3.1120 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 3.7310 0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 3.6700 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8640 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -1.4850 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -0.0440 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 1.6020 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 0.4360 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -1.7300 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.8260 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -0.0690 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 0.9230 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -0.5760 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -0.5130 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -0.3080 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -0.5280 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4410 1.0230 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 0.9980 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 0.5350 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -2.1380 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -1.7440 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -2.2700 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.4240 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.5100 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -2.5200 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 1.4130 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -2.3180 3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 2.9760 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 4.6290 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 3.8080 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 20 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 41 1 0 0 0 0 14 31 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 28 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 29 2 0 0 0 0 27 28 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 M END > 421 $$$$ 422 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 89 0 0 1 0 0 0 0 0999 V2000 0.1340 2.5720 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 1.1400 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.0340 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 2.6880 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 1.7040 2.6080 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9630 0.2800 2.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8390 -0.6620 3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -0.6370 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 1.8240 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 0.7720 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 3.3430 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 3.2380 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 2.3210 2.3060 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1210 0.9260 1.8710 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1330 0.0190 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 0.7310 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 2.2250 2.0120 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2340 0.8760 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.0750 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -1.2900 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 2.1130 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 0.7230 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 2.5350 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 3.1100 2.9850 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4020 3.0110 2.6760 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4490 4.5620 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1720 3.8830 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1380 3.3700 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9070 4.2420 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7510 3.6980 6.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3880 4.2410 4.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 5.5760 5.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8360 1.6330 2.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8570 1.2320 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3700 2.0070 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3620 -0.1850 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 2.5130 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 3.2210 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 2.8770 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 2.4640 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 3.7060 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 0.0540 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -0.3550 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -1.6820 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -1.1060 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -1.2020 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 3.2080 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 4.3500 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 3.6690 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 3.8360 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9590 -0.0260 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 -0.9810 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 0.6420 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 0.2990 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -0.4130 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.7910 4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 0.9000 4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -1.2330 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -2.1160 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.4560 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 2.2210 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 1.3470 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 3.0620 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 1.4750 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 0.8220 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -0.2710 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 2.3090 4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 1.8770 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6610 3.5720 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7240 2.7760 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5840 3.3450 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 4.6210 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 5.1810 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 4.9190 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 4.9310 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3830 2.3220 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1380 2.6800 6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3080 4.3280 7.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6970 3.6980 7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4990 4.6290 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9440 4.8720 5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 3.2230 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8500 6.1940 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8180 -0.8120 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4260 -0.2080 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2070 -0.5590 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 18 2 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 24 1 0 0 0 0 17 37 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 70 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 25 71 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 27 28 2 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 28 76 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 32 83 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 M END > 422 $$$$ 423 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0010 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6940 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -0.0020 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0910 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.4010 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 2.1790 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 3.5880 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 4.1500 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 3.4350 -0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 5.6470 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 1.6350 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.7300 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 -0.7200 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -1.3370 -1.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -0.6800 0.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7690 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 4.2060 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 5.9180 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 5.9940 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 6.1130 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -1.5590 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -0.8090 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 0.2140 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -0.9560 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 6 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 16 26 1 0 0 0 0 M END > 423 $$$$ 424 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3980 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6830 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 2.1120 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4500 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0430 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.6470 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 0.2090 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 1.5450 -0.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5330 2.1620 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -1.8370 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.7580 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.1710 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -2.2600 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 2.4650 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 3.7080 -0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 1.2940 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9210 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -1.7630 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 3.1920 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 0.3810 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8290 -0.2860 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.5970 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.7040 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -2.5650 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 2.6440 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 1.9920 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 4.3420 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 0.6400 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 2.2430 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 0.8210 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 6 2 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END > 424 $$$$ 425 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5230 -0.2650 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0380 0.0190 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -0.4040 -0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 0.6830 -0.8070 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4770 1.9510 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 0.5440 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 0.0520 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 0.0920 1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 0.6050 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.9010 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.7060 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.7520 -0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 2.3160 -3.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 2.4130 -4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 2.9250 -2.6640 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1960 1.4850 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 2.1400 -1.4800 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2080 2.1460 -1.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7000 2.7530 -0.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1590 1.9180 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 2.0020 1.0470 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2120 4.1110 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 0.7290 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.1450 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 4.3640 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 3.2820 -2.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 0.8060 -1.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -0.3540 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -0.3520 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -1.4000 -1.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 4.9570 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 6.3830 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 4.5760 1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 3.5240 -1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 2.7930 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 2.1870 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -0.3120 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 0.7560 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 1.3280 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.8400 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 3.3160 -3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 3.1140 -4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 1.4380 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 0.4660 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.4770 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 2.7500 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 2.3430 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 0.8880 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 3.0400 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 0.2410 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 0.1530 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 0.1110 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.1950 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.5210 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 4.9170 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 4.9920 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 0.6740 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -0.8210 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 -0.9100 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 6.5400 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 7.0590 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 6.5810 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 4.0330 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 17 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 24 1 0 0 0 0 21 49 1 0 0 0 0 22 31 1 0 0 0 0 23 27 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 34 63 1 0 0 0 0 M END > 425 $$$$ 426 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.3790 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.5090 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7660 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.2920 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.5760 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9260 -7.8360 -9.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.9690 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -1.3990 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.2630 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -0.5960 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 55 1 0 0 0 0 21 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 M END > 426 $$$$ 427 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -2.3980 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.5010 -1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -2.8760 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.1240 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.3040 -3.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9260 -7.8360 -9.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -0.2530 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -3.8550 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.6510 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.7710 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 23 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 M END > 427 $$$$ 428 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 65 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.3790 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.5090 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7660 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.2920 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.5760 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3520 -7.9440 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7110 -8.6290 -10.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.9690 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -1.3990 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.2630 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -0.5960 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9560 -7.0440 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -8.6250 -8.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1080 -9.5290 -10.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5140 -7.9480 -11.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7680 -8.8980 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 26 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 21 23 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 M END > 428 $$$$ 429 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 65 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -2.3980 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.5010 -1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -2.8760 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.1240 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.3040 -3.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3520 -7.9440 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7110 -8.6290 -10.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -0.2530 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -3.8550 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.6510 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.7710 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9560 -7.0440 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -8.6250 -8.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1080 -9.5290 -10.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5140 -7.9480 -11.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7680 -8.8980 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 26 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 23 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 M END > 429 $$$$ 430 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 65 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.3790 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.7780 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -1.3170 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -0.5770 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -0.5220 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3520 -7.9440 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7110 -8.6290 -10.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.3830 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.9690 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -1.4320 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -0.6230 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -2.2850 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9560 -7.0440 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -8.6250 -8.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1080 -9.5290 -10.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5140 -7.9480 -11.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7680 -8.8980 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 25 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 22 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 26 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 M END > 430 $$$$ 431 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 65 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1910 -1.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3030 -1.5690 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.2540 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.6310 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.3160 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.6940 -3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.3790 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -5.4410 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -5.8190 -6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -2.3980 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -2.8760 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.1240 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.3040 -3.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -0.5130 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -6.5040 -7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -6.8820 -7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 -7.5660 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -4.7560 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3520 -7.9440 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7110 -8.6290 -10.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.3830 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.5820 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.6690 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2500 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.1540 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -1.5730 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -1.7310 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.3120 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -4.2160 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.6350 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.7940 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -4.3750 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -5.2790 -5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.6980 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -4.7600 -7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -6.3410 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -4.9190 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -6.5000 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.6830 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -3.8550 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.6510 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.7710 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -0.2660 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -7.4040 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8310 -5.8230 -8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -5.9820 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7080 -7.5620 -7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -8.4660 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 -6.8860 -9.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.8560 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -5.4370 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9560 -7.0440 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -8.6250 -8.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1080 -9.5290 -10.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5140 -7.9480 -11.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7680 -8.8980 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 25 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 22 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 26 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 M END > 431 $$$$ 432 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.1790 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.2140 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -2.8570 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -3.9080 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -4.5510 -3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -5.6020 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 -6.2450 -5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -7.2960 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -7.9390 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -8.9900 -6.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 -9.6340 -8.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -10.6840 -8.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2220 -11.3280 -9.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.9770 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.7780 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -1.3170 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -0.5770 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -0.5220 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.3830 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -1.7380 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.9800 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -3.3330 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -2.0910 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 -3.4320 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -4.6740 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -5.0270 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -3.7850 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -5.1260 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.3680 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -6.7210 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -5.4790 -6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -6.8200 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -8.0620 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -8.4150 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -7.1730 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -8.5140 -6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -9.7560 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -10.1100 -8.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -8.8670 -8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0410 -10.2080 -7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8560 -11.4500 -7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0150 -12.0760 -9.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -11.8040 -9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -10.5610 -10.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.4250 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -0.4870 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -1.9400 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.9140 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 M END > 432 $$$$ 433 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.1790 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.2140 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -2.8570 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -3.9080 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -4.5510 -3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -5.6020 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 -6.2450 -5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -7.2960 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -7.9390 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -8.9900 -6.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 -9.6340 -8.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -10.6840 -8.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2220 -11.3280 -9.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.9770 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7660 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.2920 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.5760 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.5090 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -1.7380 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.9800 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -3.3330 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -2.0910 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 -3.4320 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -4.6740 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -5.0270 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -3.7850 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -5.1260 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.3680 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -6.7210 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -5.4790 -6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -6.8200 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -8.0620 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -8.4150 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -7.1730 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -8.5140 -6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -9.7560 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -10.1100 -8.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -8.8670 -8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0410 -10.2080 -7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8560 -11.4500 -7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0150 -12.0760 -9.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -11.8040 -9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -10.5610 -10.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.4250 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -2.3820 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -0.9560 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -0.9200 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 M END > 433 $$$$ 434 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4900 -0.3970 -0.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2220 0.9290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.9850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 1.0830 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.1790 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.2140 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -2.8570 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -3.9080 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -4.5510 -3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -5.6020 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 -6.2450 -5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -7.2960 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -7.9390 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -8.9900 -6.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 -9.6340 -8.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -10.6840 -8.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2220 -11.3280 -9.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.9770 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.1510 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7660 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.2920 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.5760 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.5090 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3340 -12.3780 -9.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 -13.0220 -10.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.1070 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3920 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.0400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -1.7380 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.9800 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -3.3330 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -2.0910 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 -3.4320 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -4.6740 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -5.0270 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -3.7850 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -5.1260 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.3680 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -6.7210 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -5.4790 -6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -6.8200 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -8.0620 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -8.4150 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -7.1730 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -8.5140 -6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -9.7560 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -10.1100 -8.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -8.8670 -8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0410 -10.2080 -7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8560 -11.4500 -7.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -11.8040 -9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -10.5610 -10.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.4250 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -1.3990 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.2630 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -0.5960 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2780 -11.9020 -9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 -13.1440 -8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5160 -13.4980 -11.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7010 -12.2550 -11.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2520 -13.7700 -10.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 26 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 M END > 434 $$$$ 435 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5070 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4460 -0.3800 0.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2230 0.8880 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1930 1.9930 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.5880 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -2.9720 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -4.0120 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -5.4160 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -6.4560 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -7.8610 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -8.9000 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -10.3050 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -11.3440 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -12.7490 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -13.7890 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -1.4480 -1.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -0.5930 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.4990 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 1.1720 0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 1.7840 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 2.1110 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 2.0740 -0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 2.1060 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.3980 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 0.7650 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 3.0470 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -3.0920 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -3.1120 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -3.8910 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -3.8710 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -5.5370 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -5.5570 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -6.3360 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -6.3160 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -7.9810 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -8.0010 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -8.7800 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -8.7600 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -10.4250 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -10.4450 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -11.2240 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -11.2040 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -12.8700 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -12.8890 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -13.6680 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -13.6480 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -14.7900 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -1.3170 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.2500 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 1.7770 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 1.6040 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 3.1880 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 17 2 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 M END > 435 $$$$ 436 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5070 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4460 -0.3800 0.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2230 0.8880 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1930 1.9930 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.5880 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -2.9720 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -4.0120 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -5.4160 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -6.4560 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -7.8610 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -8.9000 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -10.3050 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -11.3440 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -12.7490 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -13.7890 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -15.1940 -1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -16.2330 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -1.4480 -1.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -0.5930 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.4990 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 1.1720 0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 1.7840 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 2.1110 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 2.0740 -0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 2.1060 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.3980 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 0.7650 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 3.0470 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -3.0920 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -3.1120 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -3.8910 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -3.8710 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -5.5370 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -5.5570 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -6.3360 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -6.3160 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -7.9810 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -8.0010 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -8.7800 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -8.7600 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -10.4250 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -10.4450 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -11.2240 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -11.2040 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -12.8700 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -12.8890 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -13.6680 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -13.6480 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -15.3140 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -15.3340 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -16.1130 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -16.0930 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -17.2340 -2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -1.3170 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.2500 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 1.7770 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 1.6040 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 3.1880 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 M END > 436 $$$$ 437 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.1420 1.4700 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 0.7320 -0.3370 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3170 1.9420 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -0.4000 -0.5120 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1110 -0.0020 0.2880 N 0 0 3 0 0 0 0 0 0 0 0 0 0.2140 -0.5290 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -1.7170 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -1.6460 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.5650 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 0.3460 0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.6490 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 -3.7070 0.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -4.6880 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -5.8200 1.0360 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1150 -4.6630 -1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3290 -6.4230 0.6420 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8940 -6.8950 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -8.0680 1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -6.3050 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -5.3250 2.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -6.9650 -0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 -5.3370 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 -8.0170 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -8.4700 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -8.6330 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.8280 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 1.8380 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 0.9740 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.7760 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.2340 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 0.2260 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -0.8460 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.5010 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.0190 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -3.0750 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.1540 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 -7.2200 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -7.2450 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -7.6990 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.7810 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -8.5590 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -7.0710 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -5.9550 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -5.4700 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -4.6390 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -4.9300 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 -5.7670 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 -4.5400 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -8.0940 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 -8.5730 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 -9.6780 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 20 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 M END > 437 $$$$ 438 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.4610 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.1030 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.0690 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -0.6340 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.1380 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -2.7050 0.4660 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7380 -0.6410 -0.3390 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6180 -2.1570 -0.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0170 -0.5630 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -0.1960 -1.3740 N 0 0 3 0 0 0 0 0 0 0 0 0 6.1220 -2.0300 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -2.7970 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -4.1470 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -4.7870 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 -4.0230 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -2.6520 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 2.2700 0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 3.4130 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 3.5100 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -2.2960 1.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -2.1810 -0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 -4.3440 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 -3.1230 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 1.1190 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.4040 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -3.1070 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -4.1230 2.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -2.7490 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.5290 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -0.5780 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 2.0380 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.3930 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.5970 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -3.7970 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7030 -0.3350 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 0.0100 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -4.7250 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3780 -5.8400 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 3.5460 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 4.3630 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -3.1640 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6390 -2.8910 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 1.8680 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 1.2590 -2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 1.2260 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.9030 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -2.0100 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -3.4750 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -1.8050 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.6480 4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -3.5340 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 19 1 0 0 0 0 2 6 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 33 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 31 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 23 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 28 1 0 0 0 0 23 25 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END > 438 $$$$ 439 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 89 89 0 0 1 0 0 0 0 0999 V2000 0.3210 1.0940 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.0060 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 1.6540 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 0.1660 -0.6230 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0320 -0.6240 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -2.1340 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.5370 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -1.8340 -1.5580 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3080 -0.3200 -1.6830 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6570 0.3700 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 0.0180 -3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -2.2760 -2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -2.1780 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -0.4400 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 3.6720 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 4.1450 1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 2.1600 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 1.7440 -1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 0.0160 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8760 0.8020 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 1.5580 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 2.2170 -3.4120 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.4680 3.7140 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0690 4.4720 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8960 5.9680 -4.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2750 6.4540 -5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 7.9520 -5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 8.4310 -6.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 9.0730 -6.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 9.4670 -5.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4070 1.7670 -4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4140 1.8580 -4.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7480 1.8020 -4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2520 2.0460 -3.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6160 1.4360 -5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2610 6.6330 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 9.4180 -7.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.3250 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 1.7970 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 2.2110 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 0.0100 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -2.5520 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.5060 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -2.2430 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -3.6160 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 0.0330 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 1.4500 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.4740 -3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -0.3270 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.0980 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -3.2270 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -1.8450 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -1.6780 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -3.2570 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 0.3920 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -0.7520 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.2740 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 4.1680 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 3.8930 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 5.0970 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 1.9400 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 1.6650 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 0.2610 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -1.0500 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4530 0.7440 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1630 1.8820 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 4.1610 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6880 4.0250 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 6.2310 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 5.9150 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9690 6.2700 -6.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9150 8.4910 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 8.1360 -4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 8.2440 -7.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 8.6940 -5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 10.4110 -5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 9.5800 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 1.0240 -5.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 2.7660 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 1.6620 -4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7560 0.3560 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5850 1.9260 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1350 1.7620 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7030 6.2870 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1360 7.7150 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9150 6.3700 -4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 10.3970 -8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 9.4400 -7.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 8.6670 -8.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 2 0 0 0 0 1 38 1 0 0 0 0 2 5 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 19 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 58 1 0 0 0 0 15 59 1 0 0 0 0 16 60 1 0 0 0 0 17 61 1 0 0 0 0 17 62 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 19 64 1 0 0 0 0 20 21 2 0 0 0 0 20 65 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 22 66 1 0 0 0 0 23 24 2 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 25 69 1 0 0 0 0 26 27 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 27 28 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 28 29 2 0 0 0 0 28 74 1 0 0 0 0 29 30 1 0 0 0 0 29 37 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 37 87 1 0 0 0 0 37 88 1 0 0 0 0 37 89 1 0 0 0 0 M END > 439 $$$$ 440 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5410 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -0.3770 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 0.6670 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 1.8770 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 0.6460 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 1.8920 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -0.3760 1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 2.0780 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 2.8510 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 1.7270 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.9200 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.3980 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.3790 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -1.3560 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 2.0300 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 2.7630 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 2.6850 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 1.6850 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 2.2100 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 3.1030 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 3.2360 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 0.8150 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 2.5410 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 1.5690 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 M END > 440 $$$$ 441 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -0.4200 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 0.6420 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 1.9140 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 0.5840 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 1.8580 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -0.4900 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 2.2950 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 1.7020 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 3.7910 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.3880 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -0.3790 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -1.4440 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 2.5020 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 2.4930 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 2.1600 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 1.6930 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 2.6440 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 1.0830 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 2.5050 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 1.0920 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 4.1570 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 4.2560 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 4.0430 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 9 2 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 M END > 441 $$$$ 442 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3940 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 2.1080 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4420 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -0.6110 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 2.1560 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 1.4400 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 0.0410 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 -0.4580 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 0.5540 -0.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2130 1.8670 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.6890 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.9120 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.1590 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -2.0300 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 0.4230 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 -0.9390 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2070 1.5340 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 0.5360 1.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 3.5120 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 4.1550 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 0.4410 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 0.5490 3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2560 0.2700 1.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9130 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.1880 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 0.5040 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 2.6460 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 2.1980 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -2.2810 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -2.9950 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -1.0240 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8500 -1.0320 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2200 -1.7310 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 2.5040 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1690 1.4410 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3520 1.4500 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 3.8710 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 3.8500 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 5.2360 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0050 0.7000 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4150 -0.3690 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 1.3930 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 8 2 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END > 442 $$$$ 443 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 162171 0 0 1 0 0 0 0 0999 V2000 -4.4980 4.9570 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 3.5550 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 2.6700 -1.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 3.2290 -2.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -5.0230 3.8020 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1610 -5.6780 2.5520 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2710 -4.5830 1.5720 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9340 -3.6970 1.2450 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4590 -3.1440 2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -4.1200 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.6400 0.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -6.0350 4.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -6.4650 2.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -5.1830 0.3720 O 0 0 0 0 0 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0 0 20 22 1 0 0 0 0 20 59 1 0 0 0 0 21 26 1 0 0 0 0 21 29 1 0 0 0 0 22 36 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 29 34 2 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 35 82 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 M END > 444 $$$$ 445 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 -0.2640 2.3970 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 2.5880 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 0.9270 0.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0070 0.0560 1.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3780 -1.4080 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -1.5510 1.3410 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5090 -0.6920 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.7720 0.4700 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5330 0.1820 1.4840 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9190 1.6300 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 2.1090 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 1.2600 3.4130 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5800 -0.1780 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -0.6580 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 1.6360 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -2.9200 1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 0.5140 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 1.2240 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 1.2530 1.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 1.8040 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 1.2800 4.7360 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5120 0.4940 5.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 0.4120 7.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 2.6310 5.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -0.2500 8.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -0.7450 7.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -0.3760 9.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 0.6190 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -0.2140 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 2.6890 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 3.0180 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 2.3700 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 3.6140 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.7370 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.0230 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -1.2180 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -1.0180 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.7970 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 3.1680 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -0.2030 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -0.8200 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -0.5800 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -1.7000 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 1.3150 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 1.5260 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 2.6800 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -3.0840 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 0.4840 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 1.5320 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -0.1500 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.5270 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 2.2210 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 1.5320 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 2.8290 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 1.1860 4.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 1.7840 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 0.8240 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.5110 5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 1.0000 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 3.0720 5.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.8940 9.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -0.9420 10.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 0.6180 9.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 10 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 25 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 M END > 445 $$$$ 446 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 0 1 0 0 0 0 0999 V2000 0.7310 -4.7360 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -6.1940 -2.5180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5540 -6.7460 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -3.8820 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -4.3630 -0.4480 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5660 -5.8390 -0.4770 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9620 -6.2770 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -5.6370 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -3.5850 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -4.1750 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -1.3440 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -2.1350 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -1.8950 1.5000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5220 -3.3760 1.2880 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1150 -3.7180 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 -2.4830 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 -1.3110 2.1130 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3100 -6.9930 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -8.1190 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.9900 -3.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -7.1310 -4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -7.9430 -5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -6.6060 -5.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -4.0710 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -1.5490 -0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6390 -3.5050 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -1.7660 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -0.1550 3.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5010 -5.9180 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 0.3580 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 1.4290 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 1.9340 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 1.9160 6.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 1.5310 7.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6290 2.2800 7.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 0.9770 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -4.3740 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -4.6420 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -6.2700 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -3.9700 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -2.8420 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -5.9590 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -7.3620 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -5.7320 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -6.1620 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -1.4600 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -0.2830 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -3.8180 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -4.6260 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 -2.2400 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 -2.6830 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 -0.9740 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -7.8090 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -7.2580 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -6.0900 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -7.9850 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -8.5590 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -8.7810 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -7.2960 -5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -8.3910 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -8.7300 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -4.4800 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -4.5310 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.9930 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -3.1160 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5090 -2.9350 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 -4.5540 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -2.3390 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -2.1500 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.7180 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 -0.5040 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 -0.4680 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 0.7890 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 2.2560 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 0.9990 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0360 2.3120 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 0.4450 7.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 1.9630 8.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 1.9070 7.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 3.3520 7.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 1.7370 8.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 2.0140 6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 1.3260 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 0.6110 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 1.8010 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 25 2 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 28 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 28 71 1 0 0 0 0 30 31 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 32 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 33 2 0 0 0 0 32 76 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 M END > 446 $$$$ 447 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 2.0450 2.5360 -3.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 1.8410 -4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 1.4470 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.7610 -6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 1.8200 -5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 1.5400 -4.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 0.3880 -6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 4.0540 -2.2840 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1420 4.0840 -1.5780 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1840 5.2960 -0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 5.9970 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 5.3080 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 1.5830 0.0880 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9910 2.7880 -1.9660 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2320 2.9190 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 2.4440 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 1.3800 1.4120 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3370 2.4390 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 2.8300 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 1.0490 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 5.7260 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 7.0740 -0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 3.1830 1.5100 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2910 4.5100 1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 1.5310 1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 0.3470 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 5.4470 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 6.6810 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 5.3010 3.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 0.4720 -7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 2.7910 -5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.0680 -5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 1.8730 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 1.2920 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6.5920 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 6.7860 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 7.5570 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 7 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 2 0 0 0 0 12 21 2 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 25 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END > 447 $$$$ 448 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -3.6720 -0.0440 0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -2.4020 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -1.1580 0.4760 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9540 -0.8570 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -3.6170 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -3.3980 -1.2240 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1440 -2.1000 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -1.9790 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -3.1390 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -4.5940 -1.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2380 -4.2130 -2.2890 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8590 -6.9300 -2.2860 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7510 -5.6990 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -6.6170 -3.1450 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1230 -5.4020 -2.5800 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8020 -5.9570 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -7.3690 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -7.7820 -2.9280 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2200 -9.9930 -3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -3.2930 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -3.6750 -3.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -8.0070 -2.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -6.4260 -4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -5.0120 -3.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -4.9660 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -9.3120 -1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -9.0500 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -8.7270 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -8.4660 -0.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -9.8600 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 0.7810 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -2.5770 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -2.2470 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -1.3350 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -0.6000 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.0280 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -3.7450 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 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0 0 19 27 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 22 28 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 26 27 2 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 M END > 448 $$$$ 449 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 166174 0 0 1 0 0 0 0 0999 V2000 2.8520 6.2840 9.9580 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6160 7.0730 8.8900 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9400 6.1420 7.7170 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7380 4.9420 8.2340 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9840 4.2700 9.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 5.0780 10.3880 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6070 7.1240 11.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 6.8480 6.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 4.2520 11.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 8.1590 8.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 4.0400 7.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 3.1930 11.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 3.0160 7.4680 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4450 1.6760 6.9170 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5020 0.6010 7.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 1.0310 6.5610 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2190 2.2990 7.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 3.3530 6.8290 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8350 0.0600 6.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 4.6610 7.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 1.3170 7.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 0.5370 6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0400 1.0480 6.9720 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3640 1.1660 6.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8860 -0.2370 5.8900 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9050 -0.9470 5.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 -1.1290 5.8100 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0500 0.2380 6.1280 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7030 -1.9200 4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2620 0.3840 8.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0930 -0.1350 5.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3930 -2.0240 3.6510 C 0 0 1 0 0 0 0 0 0 0 0 0 15.2040 -3.3100 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6960 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0 26.9460 -8.8560 8.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 28.2540 -8.1050 7.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0230 -9.1620 8.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5580 -9.5620 7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5670 -8.9270 8.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7740 -9.3020 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5600 -9.9680 6.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 24.8640 -9.8430 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 25.2530 -9.8340 7.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2800 -7.8130 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1780 -8.8910 10.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4830 -7.2370 11.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0830 -8.1510 12.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 68 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 69 1 0 0 0 0 3 4 1 0 0 0 0 3 70 1 0 0 0 0 3 71 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 72 1 0 0 0 0 5 6 1 0 0 0 0 6 8 1 0 0 0 0 6 73 1 0 0 0 0 7 17 1 0 0 0 0 8 74 1 0 0 0 0 8 75 1 0 0 0 0 8 76 1 0 0 0 0 9 77 1 0 0 0 0 10 11 1 0 0 0 0 11 78 1 0 0 0 0 11 79 1 0 0 0 0 11 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0 0 39111 1 0 0 0 0 39112 1 0 0 0 0 40 41 1 0 0 0 0 40113 1 0 0 0 0 41 44 1 0 0 0 0 41114 1 0 0 0 0 41115 1 0 0 0 0 42 43 1 0 0 0 0 42116 1 0 0 0 0 42117 1 0 0 0 0 43 44 1 0 0 0 0 43 47 1 0 0 0 0 43 57 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 45118 1 0 0 0 0 46 48 1 0 0 0 0 46119 1 0 0 0 0 46120 1 0 0 0 0 47 48 1 0 0 0 0 47 50 1 0 0 0 0 47 62 1 0 0 0 0 48 52 1 0 0 0 0 48 58 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 59 1 0 0 0 0 49121 1 0 0 0 0 50122 1 0 0 0 0 50123 1 0 0 0 0 51 52 1 0 0 0 0 51 55 1 0 0 0 0 51 60 1 0 0 0 0 52 53 1 0 0 0 0 52 61 1 0 0 0 0 53 54 1 0 0 0 0 53124 1 0 0 0 0 53125 1 0 0 0 0 54 55 1 0 0 0 0 54126 1 0 0 0 0 54127 1 0 0 0 0 55 63 1 0 0 0 0 55128 1 0 0 0 0 56 63 1 0 0 0 0 56129 1 0 0 0 0 56130 1 0 0 0 0 56131 1 0 0 0 0 57132 1 0 0 0 0 57133 1 0 0 0 0 57134 1 0 0 0 0 58135 1 0 0 0 0 59 65 1 0 0 0 0 60136 1 0 0 0 0 60137 1 0 0 0 0 60138 1 0 0 0 0 61139 1 0 0 0 0 63 64 2 0 0 0 0 65 66 1 0 0 0 0 65 67 2 0 0 0 0 66140 1 0 0 0 0 66141 1 0 0 0 0 66142 1 0 0 0 0 M END > 453 $$$$ 454 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.6730 1.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -0.6100 -0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -2.2540 0.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -4.7860 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -6.2110 2.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -2.6870 1.6080 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5830 -2.1230 0.9260 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6610 -2.6560 1.6430 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6320 -4.1860 1.6290 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5700 -4.6440 2.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -4.2160 1.5950 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8340 -2.1940 0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -4.6910 2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -6.1130 2.2970 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1540 -6.5300 0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -6.1940 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -5.9110 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -6.5480 3.1910 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3680 -5.9320 2.6860 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4580 -6.9040 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -8.2590 3.4230 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2820 -8.0680 3.0480 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6220 -5.5720 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 -5.2780 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -5.5440 -0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -4.9310 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -6.2710 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -8.8420 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -8.6360 4.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -2.5750 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -4.5050 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -4.3880 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -6.6410 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -2.3330 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.4360 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -2.3010 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -4.5410 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -4.5710 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -2.4950 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -6.5750 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -6.1520 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 -6.5370 4.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 -7.0090 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -9.0220 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -8.3880 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -5.0580 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -9.9060 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -8.6750 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -8.4950 5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -8.7510 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 9 1 0 0 0 0 5 8 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 49 1 0 0 0 0 24 30 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END > 454 $$$$ 455 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 3.1180 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 4.3720 2.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7080 2.2610 -1.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0240 3.0440 -1.4420 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8320 4.3480 -0.6630 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3940 4.0480 0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.3580 0.7240 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8980 1.0090 -2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 3.3420 -2.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 5.0570 -0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 6.3460 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1400 7.2070 -0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 7.5780 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 7.5640 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 6.9560 0.1200 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9880 7.1370 -1.2800 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0000 8.2910 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 9.0900 0.1320 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2680 8.4000 0.6590 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3710 7.9760 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6850 7.9760 -3.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 8.3290 -4.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 6.2220 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 6.3400 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 8.4010 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5630 9.0680 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.0780 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.3980 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -1.4070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 2.5930 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 2.5140 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 4.2950 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.3970 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 2.8380 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 2.4460 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 4.9620 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 3.9600 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 1.0900 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 3.8380 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 6.2470 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 7.8980 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9990 7.8890 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 8.9310 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 10.1190 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 8.8930 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 8.2730 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 9.4290 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 7.8880 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 7.8870 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 9.4690 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 49 1 0 0 0 0 24 30 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END > 455 $$$$ 456 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.5020 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0300 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5690 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0420 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.6160 -1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9770 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8650 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 5.4580 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9940 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.6080 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 0.1880 -2.7160 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9960 -0.3270 -1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -0.0150 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 0.3390 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -0.1630 -4.1240 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9140 0.4310 -4.3780 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5230 -0.4860 -5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -1.8280 -5.3760 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7420 -1.6860 -4.2400 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1380 0.6460 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 1.0100 -4.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 0.5830 -2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 1.4620 -4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.1900 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -2.3960 -4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -2.0980 -6.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9330 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 3.6390 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 4.0010 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 1.6100 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5450 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 4.8180 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8600 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7360 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.2590 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9680 -0.0530 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -0.0420 -6.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 -0.6360 -5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -2.6310 -5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -2.0840 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 1.2000 -4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -3.4590 -4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -2.2640 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -1.9710 -5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -2.1780 -7.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.5040 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -2.4610 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -2.5300 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 20 46 1 0 0 0 0 21 27 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END > 456 $$$$ 457 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.6590 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6220 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -9.2190 4.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -9.9690 3.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -7.9450 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -7.5230 0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -8.6660 2.9840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7480 -8.7560 2.8500 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3050 -7.3670 2.5230 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6390 -6.8460 1.2470 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2220 -6.8160 1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -8.0950 1.6890 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7170 -7.4530 2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -5.5270 0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -4.9890 -0.2690 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1710 -5.7670 -1.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -5.2860 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -3.9970 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -3.5360 -0.4070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6000 -2.9720 -1.7530 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1200 -2.6320 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -2.1100 -0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3710 -2.6900 0.6580 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4980 -3.5780 -4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -2.2840 -4.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -4.3850 -5.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -2.0790 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -3.4560 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -1.5550 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -9.3000 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -10.3940 4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -7.2030 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -8.9030 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -7.4080 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -8.0120 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -9.4490 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -6.6870 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -7.5050 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -8.7700 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -6.6070 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -5.0280 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -5.9640 -3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.8580 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -3.5250 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.4520 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -3.3180 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.0940 -5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -0.9500 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -1.9750 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -0.9320 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 24 1 0 0 0 0 5 10 1 0 0 0 0 5 35 1 0 0 0 0 6 9 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 31 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END > 457 $$$$ 458 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 84 0 0 1 0 0 0 0 0999 V2000 -0.3340 1.5010 -0.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2980 0.3720 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 1.8550 0.6090 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9500 2.3100 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 0.4060 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 1.7550 1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.7130 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.0600 3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -0.3020 0.7440 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1620 0.0120 -0.1940 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2860 -2.5290 -0.3690 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2040 -1.7830 0.9720 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0000 -2.2790 -1.1400 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1950 -0.8090 -1.4790 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5970 -0.6450 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -1.5040 -3.3570 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5440 -2.9770 -3.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2340 -3.2560 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -3.3110 -3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -4.6750 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -2.5060 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -3.4130 -2.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -1.3040 -3.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -0.3160 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 0.3610 -5.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -0.0500 -5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -3.8960 -2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 -4.3670 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -3.9530 -4.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -0.2740 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 2.0410 0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 3.0990 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 3.7110 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 3.5620 -0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -2.1130 -1.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -2.7940 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 -2.4160 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -3.7080 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.3270 1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -3.3710 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -3.9890 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -3.8160 2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -0.2970 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 1.6460 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 0.2290 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 0.0360 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 2.4880 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 2.2460 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 3.3670 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 3.6700 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 2.5310 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -3.5980 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -1.9280 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -0.9580 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 0.4010 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -1.2060 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -3.5640 -3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -3.5030 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -4.1100 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.3590 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -4.6940 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -5.3950 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -4.9350 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -0.7550 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 0.9670 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -0.1710 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 -3.5350 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -5.1630 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -4.7450 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -0.4600 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -0.7790 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 0.7980 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 3.1640 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 4.7530 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 3.6590 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -1.5760 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6290 -2.1340 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -3.2670 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -3.4580 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -5.0360 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -3.9180 4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 1 31 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 47 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 52 1 0 0 0 0 12 39 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 76 1 0 0 0 0 37 77 1 0 0 0 0 37 78 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 M END > 458 $$$$ 459 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 2.0330 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 1.4860 1.2350 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2500 -0.0160 -0.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4040 1.4610 0.1210 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5880 1.9490 1.3030 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1280 -0.0440 1.2240 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7270 -0.5130 1.1670 N 0 0 3 0 0 0 0 0 0 0 0 0 0.6670 -1.9800 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.5880 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -2.0910 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -0.5560 -0.0130 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7270 -0.5500 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 1.5270 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 0.0190 2.8540 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3800 -0.2540 4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 -0.8400 0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -0.2620 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 2.2530 -1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 1.8330 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 2.5360 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 2.1370 -1.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 3.3520 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -0.8370 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 -1.6740 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6730 -0.1620 -1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8910 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8800 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -0.3700 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.3550 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 1.6820 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 3.1230 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -0.0940 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 1.6440 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 3.0570 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -2.3370 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -2.2970 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -3.6760 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -2.2990 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -2.4380 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.4660 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -0.2970 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -1.6440 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 1.8410 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 2.0330 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 -0.4890 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 0.2570 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -1.3260 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 0.1160 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 3.6200 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 4.2590 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 2.7670 -4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 -2.2090 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -2.3910 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4190 -1.0280 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 9 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 35 1 0 0 0 0 7 15 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 19 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 25 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 M END > 459 $$$$ 460 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -0.0370 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.7090 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -2.0350 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.1520 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.8920 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.3560 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 2.0530 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 3.5560 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 2.0950 -0.1600 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6020 3.4690 0.5170 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4270 4.1990 0.0850 N 0 0 3 0 0 0 0 0 0 0 0 0 2.7930 5.2020 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 5.5240 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 4.1920 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 1.3870 0.4140 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9600 3.6110 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 2.1630 0.1090 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8370 1.5420 -0.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 1.2680 1.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 0.2100 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -0.5910 1.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 0.0200 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 3.3930 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 2.2600 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.5760 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.2910 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.9760 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 3.9380 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 3.8250 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 4.7970 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 6.0920 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 5.8640 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 6.2650 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 0.3910 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 4.1930 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 2.1010 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6960 1.9290 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 0.8360 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -0.9290 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 0.0170 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 9 2 0 0 0 0 1 27 1 0 0 0 0 2 4 1 0 0 0 0 2 8 2 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END > 460 $$$$ 461 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -0.0370 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.3560 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 2.0530 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 3.5570 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 2.0940 -0.1630 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9540 3.6180 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 2.1760 0.1340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9030 1.3920 0.4220 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.7090 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -2.0340 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.1520 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.8930 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 3.4700 0.5090 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4240 4.1980 0.0890 N 0 0 3 0 0 0 0 0 0 0 0 0 2.7820 5.2470 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 5.5500 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 4.1970 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 1.5360 -0.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 1.2700 1.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.3970 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 2.2540 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2170 1.5530 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7920 2.0860 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 0.9080 -2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 1.9240 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.5760 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 3.9390 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 3.8250 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 4.1970 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 2.1320 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 0.3970 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.2910 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -2.9760 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 4.8910 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 6.1310 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 5.9300 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 6.2530 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 0.8300 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 1.6420 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9540 0.5410 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4380 0.0750 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 2 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 16 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 9 1 0 0 0 0 6 15 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 32 1 0 0 0 0 9 21 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 20 24 1 0 0 0 0 21 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END > 461 $$$$ 462 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 -3.5590 4.9330 2.3460 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2420 3.6900 2.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 3.2800 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 3.9380 4.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 1.9990 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 11.2660 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 12.1200 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 11.3910 -1.2090 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3380 10.1190 -0.8330 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1620 9.9350 -1.1520 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7260 9.1270 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 7.7150 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 8.8150 -0.9950 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3520 7.6480 -0.3240 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2080 7.6480 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 8.9920 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 6.9640 0.9050 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1140 6.6940 0.5840 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3600 5.9410 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 4.6330 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 5.6280 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 11.4900 -1.9980 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0910 10.8490 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 12.9620 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 13.0590 -3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 14.5090 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 14.9480 -4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 16.3820 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 9.2270 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 6.2620 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 4.7450 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 10.5700 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 5.8750 1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 7.6210 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 8.6000 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 16.8270 -6.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 17.1680 -3.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 13.9730 -5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 11.7950 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 5.5840 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 1.1680 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 2.0740 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 1.8280 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 11.8590 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 10.8780 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 12.1890 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 13.1170 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 9.1030 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 9.5660 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 7.2290 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 7.1580 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 7.8060 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 7.0330 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 9.5050 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 9.6000 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 5.7200 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 6.5490 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 4.1090 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 4.0040 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 10.9700 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 9.7720 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 11.0560 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 11.2630 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 13.4410 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 13.4630 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 12.5800 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 12.5580 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 15.1910 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 9.2040 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 8.2080 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 9.7650 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 6.2440 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 5.4980 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 4.5670 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 3.7930 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 5.2450 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 10.9720 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 9.7180 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 11.3400 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 6.3780 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 4.9220 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 6.5010 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 17.7790 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 13.8220 -6.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 14.3710 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 13.0210 -5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 14 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 35 1 0 0 0 0 14 18 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 31 1 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 2 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 38 1 0 0 0 0 28 36 1 0 0 0 0 28 37 2 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 36 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 38 86 1 0 0 0 0 M END > 462 $$$$ 463 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0110 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1590 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 3.5060 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 4.1800 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 5.6940 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0420 6.3920 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 7.3100 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 7.7090 -1.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 8.6430 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 8.8770 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6520 8.0740 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 1.5640 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 6.0980 -1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 9.1980 -3.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 7.1750 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 7.7610 -0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 7.6530 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.7660 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -0.5230 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 3.8880 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 3.8980 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 5.9660 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 6.1520 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3550 9.5730 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 8.0050 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 7.1630 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 8.7320 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 7.4100 -3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 17 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END > 463 $$$$ 464 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 104103 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.4010 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0840 -0.1270 0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8140 -0.6100 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1500 2.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0350 -0.7660 3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 1.8710 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -0.5850 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 0.1440 0.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -1.9520 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 1.2750 2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.8510 3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 1.8780 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 3.4060 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 3.8830 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 5.4120 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 5.8880 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 7.4170 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 7.8940 -4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 9.4220 -4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 9.8990 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 11.4280 -6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 11.9040 -7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 13.4330 -7.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 13.9100 -8.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 15.4380 -8.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 15.9150 -9.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8900 17.4430 -9.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 17.9200 -10.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 19.4490 -10.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5330 19.9260 -12.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6010 21.4540 -12.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3880 21.9310 -13.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4570 23.4590 -13.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2440 23.9360 -14.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3120 25.4650 -14.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1000 25.9420 -15.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 1.8150 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.5410 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -1.6990 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.1940 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.4700 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.4390 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -1.8530 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.4460 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 1.4570 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 2.9600 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 1.5310 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -2.4240 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -2.5640 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -1.8560 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.5320 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 2.9380 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 1.5230 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 1.5380 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 1.4690 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 3.7470 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 3.8150 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 3.5430 -3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 3.4740 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 5.7520 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 5.8200 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 5.5480 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 5.4800 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 7.7570 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 7.8260 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 7.5530 -5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 7.4850 -4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 9.7620 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 9.8310 -4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 9.5590 -7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2650 9.4900 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 11.7680 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 11.8360 -6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 11.5640 -8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 11.4950 -7.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 13.7730 -6.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 13.8420 -7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 13.5690 -9.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 13.5010 -8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 15.7780 -7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 15.8470 -8.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 15.5750 -10.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 15.5060 -9.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3880 17.7840 -8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 17.8520 -9.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 17.5800 -11.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6870 17.5110 -10.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2440 19.7890 -10.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 19.8580 -11.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0350 19.5850 -13.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5430 19.5170 -12.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0990 21.7940 -11.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 21.8630 -12.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 21.5900 -14.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3980 21.5220 -13.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9540 23.8000 -12.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 23.8680 -13.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 23.5960 -15.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2540 23.5270 -14.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8100 25.8050 -13.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 25.8740 -14.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6020 25.6010 -16.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1090 25.5330 -15.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1480 27.0300 -15.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 56 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 58 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 60 1 0 0 0 0 15 61 1 0 0 0 0 16 17 1 0 0 0 0 16 62 1 0 0 0 0 16 63 1 0 0 0 0 17 18 1 0 0 0 0 17 64 1 0 0 0 0 17 65 1 0 0 0 0 18 19 1 0 0 0 0 18 66 1 0 0 0 0 18 67 1 0 0 0 0 19 20 1 0 0 0 0 19 68 1 0 0 0 0 19 69 1 0 0 0 0 20 21 1 0 0 0 0 20 70 1 0 0 0 0 20 71 1 0 0 0 0 21 22 1 0 0 0 0 21 72 1 0 0 0 0 21 73 1 0 0 0 0 22 23 1 0 0 0 0 22 74 1 0 0 0 0 22 75 1 0 0 0 0 23 24 1 0 0 0 0 23 76 1 0 0 0 0 23 77 1 0 0 0 0 24 25 1 0 0 0 0 24 78 1 0 0 0 0 24 79 1 0 0 0 0 25 26 1 0 0 0 0 25 80 1 0 0 0 0 25 81 1 0 0 0 0 26 27 1 0 0 0 0 26 82 1 0 0 0 0 26 83 1 0 0 0 0 27 28 1 0 0 0 0 27 84 1 0 0 0 0 27 85 1 0 0 0 0 28 29 1 0 0 0 0 28 86 1 0 0 0 0 28 87 1 0 0 0 0 29 30 1 0 0 0 0 29 88 1 0 0 0 0 29 89 1 0 0 0 0 30 31 1 0 0 0 0 30 90 1 0 0 0 0 30 91 1 0 0 0 0 31 32 1 0 0 0 0 31 92 1 0 0 0 0 31 93 1 0 0 0 0 32 33 1 0 0 0 0 32 94 1 0 0 0 0 32 95 1 0 0 0 0 33 34 1 0 0 0 0 33 96 1 0 0 0 0 33 97 1 0 0 0 0 34 35 1 0 0 0 0 34 98 1 0 0 0 0 34 99 1 0 0 0 0 35 36 1 0 0 0 0 35100 1 0 0 0 0 35101 1 0 0 0 0 36102 1 0 0 0 0 36103 1 0 0 0 0 36104 1 0 0 0 0 M END > 464 $$$$ 465 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 55 55 0 0 0 0 0 0 0 0999 V2000 0.1320 1.5250 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 0.0320 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.3820 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.8980 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -2.3120 3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -3.8280 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -4.2410 4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -5.7570 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -6.1710 6.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -7.6870 6.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -8.1000 7.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -9.6170 7.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.3240 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 3.7960 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 4.3810 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 3.5820 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 2.1090 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 4.5160 -0.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 1.3890 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 4.1220 0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.7850 -0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 5.5440 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 1.9000 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 1.4310 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 2.3800 -2.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -0.4660 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -0.2560 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.1160 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -0.0940 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -2.3960 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.1860 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -1.8140 3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.0240 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.3260 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -4.1160 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -3.7430 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.9530 5.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -6.2550 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -6.0450 4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -5.6730 6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -5.8830 6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -8.1850 5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -7.9750 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -7.6030 8.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -7.8130 8.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -10.1140 7.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -9.9040 7.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -9.9110 9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 5.4520 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 5.8710 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 5.8450 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 6.0020 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 1.0310 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 0.6530 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 2.2700 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 2 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 19 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 M END > 465 $$$$ 466 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 85 0 0 1 0 0 0 0 0999 V2000 0.7500 1.1060 0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.2270 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -1.1260 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -0.7060 0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 3.2240 1.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9260 1.9110 0.2430 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9860 2.2230 -1.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1120 3.0620 -1.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 4.3240 -0.8500 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0540 4.0960 0.6640 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8660 2.9450 2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 5.3540 1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 5.1440 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.8660 -7.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 1.5900 -8.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 1.2630 -7.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8170 -6.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 1.4870 -5.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 1.2080 -6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.8910 -5.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 0.8280 -4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 1.0810 -3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 1.4240 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 1.0050 -1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.6570 -3.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 2.0870 -5.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 1.6410 -9.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 0.4740 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -0.4910 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -0.8220 -1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 -0.1980 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 0.7650 -3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 1.0970 -3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 -0.5280 -1.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 5.4480 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 6.9690 -5.0790 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3250 6.3680 -4.5930 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3180 6.3080 -3.0630 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1120 7.6210 -2.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 8.2140 -2.9200 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8190 8.3510 -4.4440 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4120 7.1850 -5.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 8.8910 -4.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 7.0970 -6.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 9.5980 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 1.3750 -3.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7420 2.2630 -4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.9160 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.1670 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -0.9440 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 3.7480 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 1.3630 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 2.7340 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 4.8630 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 3.5930 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 3.7330 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 5.2840 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 6.0710 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 4.5700 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 2.1240 -7.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 1.0500 -8.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 3.0200 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 2.5100 -9.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -0.9780 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -1.5680 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 1.8440 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 -1.2530 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 6.3200 -4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 5.3620 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 5.9210 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 7.5840 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 9.0140 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 6.8630 -4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 9.7670 -4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 6.2600 -6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 10.2290 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 10.0510 -2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 9.5010 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 2.6130 -5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2870 1.7390 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 3.1160 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 48 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 54 1 0 0 0 0 10 12 1 0 0 0 0 10 55 1 0 0 0 0 11 56 1 0 0 0 0 12 57 1 0 0 0 0 13 35 1 0 0 0 0 13 58 1 0 0 0 0 13 59 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 14 60 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 19 2 0 0 0 0 16 61 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 2 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 46 1 0 0 0 0 33 66 1 0 0 0 0 34 67 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 36 44 1 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 42 1 0 0 0 0 37 69 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 45 1 0 0 0 0 40 71 1 0 0 0 0 41 43 1 0 0 0 0 41 72 1 0 0 0 0 42 73 1 0 0 0 0 43 74 1 0 0 0 0 44 75 1 0 0 0 0 45 76 1 0 0 0 0 45 77 1 0 0 0 0 45 78 1 0 0 0 0 46 47 1 0 0 0 0 47 79 1 0 0 0 0 47 80 1 0 0 0 0 47 81 1 0 0 0 0 M END > 466 $$$$ 467 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 1.0950 2.5930 0.3290 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3300 0.3760 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.0960 0.0770 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8310 6.8660 5.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 7.6740 5.9890 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7720 8.3330 5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 5.7700 4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 6.4120 3.4770 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0830 7.3040 4.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0290 7.8930 3.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 6.7230 2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 5.3400 2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 5.5010 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 3.1040 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 4.0730 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 3.0370 1.5540 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8260 4.4380 1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 4.5640 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 3.2910 0.6080 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2900 2.5180 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.5580 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 0.2120 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 0.6000 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8010 -1.6490 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 -0.8990 1.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -0.5480 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -0.8620 3.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 9.5240 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 2.1960 2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.3610 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 8.8780 6.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 7.1870 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 3.2470 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 1.2200 0.9360 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2850 6.8030 6.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 6.6780 8.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 5.7920 9.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 7.2760 8.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 0.1300 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -0.5670 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 0.9940 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 6.3900 5.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 7.5140 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 8.4560 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 5.1060 5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 5.1920 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 6.6260 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 8.3500 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 8.6380 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 7.0420 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 6.4650 3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 2.1080 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 3.3670 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 3.5180 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 4.3490 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 5.4560 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 3.5050 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 0.3640 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 1.6860 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 0.2310 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 0.1650 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 -2.5840 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7450 -1.8660 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 -1.0610 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 10.3100 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 9.9040 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 9.2120 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 1.1870 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 2.1500 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 2.6550 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 0.7590 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.7020 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 0.5000 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 8.0540 6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 9.3590 5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 9.6040 6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 7.8770 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 7.7480 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 6.4890 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 2.8210 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 4.3210 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 3.0610 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 1.3150 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 5.3400 8.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 6.3870 10.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 5.0080 9.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 16 1 0 0 0 0 1 19 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 30 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 44 1 0 0 0 0 6 9 1 0 0 0 0 6 28 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 34 83 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 37 86 1 0 0 0 0 M END > 467 $$$$ 468 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 -0.9760 1.6120 -1.2910 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8990 0.0870 -1.1680 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1430 -0.4440 -2.1560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4060 0.1690 -1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 1.5910 -2.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4150 2.2040 -1.0430 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8100 2.1320 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 3.6200 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 2.1240 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -0.4810 -1.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 4.3510 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 1.6420 -2.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 2.0280 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 1.5590 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 2.7500 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -1.8610 -2.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.4750 -2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -4.1750 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -4.2650 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -3.9810 -2.7120 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8900 -5.1200 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -4.6890 -3.8710 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8410 -4.7440 -3.8360 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2660 -4.4040 -5.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -5.5350 -6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -5.6850 -4.9090 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1790 -5.6170 -6.2590 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7210 -4.4590 -7.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -5.0090 -7.4760 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9620 -4.9520 -6.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 -5.7210 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -3.2920 -4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -6.8850 -7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -6.4550 -7.9020 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9980 -7.3920 -7.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -6.4660 -9.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -8.7120 -8.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -4.4680 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -6.6880 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -5.8230 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 1.8810 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -0.1830 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -0.2090 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.8520 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.9770 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 3.2210 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 1.7950 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 1.7850 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -1.4460 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 4.0440 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 4.1480 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 5.4180 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 0.9200 -4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 2.4220 -4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8070 0.9960 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -2.2860 -3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -2.0570 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 -3.1530 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -4.4860 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -5.2650 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -3.5390 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 -5.0870 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -6.1360 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.3530 -5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -3.4620 -5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -6.4820 -5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -5.3360 -7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -4.3520 -8.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -3.5090 -6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5890 -4.4370 -8.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 -5.3060 -6.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -3.8940 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -5.3330 -4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -6.7700 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 -3.3400 -4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -2.9070 -5.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -2.6300 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -7.6660 -6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -7.2140 -7.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -7.0440 -8.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -7.4040 -6.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -7.3450 -9.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 -9.3630 -8.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -3.9230 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -4.2890 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -5.5350 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 44 1 0 0 0 0 6 8 1 0 0 0 0 6 45 1 0 0 0 0 7 12 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 11 1 0 0 0 0 9 48 1 0 0 0 0 10 49 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 16 17 1 0 0 0 0 17 20 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 32 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 27 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 32 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 33 34 1 0 0 0 0 33 78 1 0 0 0 0 33 79 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 38 86 1 0 0 0 0 M END > 468 $$$$ 469 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 0.5410 0.2960 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.0180 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.5080 0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -1.8830 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 1.0670 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 9.3790 6.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 12.0410 7.9560 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5680 11.2160 7.4680 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0680 10.1180 6.5250 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6400 10.7130 5.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 11.4590 5.8280 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3700 12.6100 6.7430 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4840 12.0230 4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 10.9470 3.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 13.3220 7.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 13.1140 8.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 10.6200 8.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 14.7080 7.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 8.2550 5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 6.0430 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 7.0920 5.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 7.5320 4.7290 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3040 4.8530 4.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 5.3240 3.6050 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6740 6.3580 3.8770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0050 6.7800 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 5.5560 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 4.1280 2.8960 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2750 4.4550 1.6950 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1180 4.8090 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 3.4100 0.1040 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7170 3.0600 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 3.0110 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 5.8850 2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 8.5670 3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 3.1410 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 2.5260 0.1750 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7380 2.6120 -1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 3.6830 3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 5.8180 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -1.2700 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -2.6610 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -2.3430 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 0.9940 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.6760 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 11.4050 8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 11.8630 6.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 9.4470 7.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 10.8060 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 13.2860 6.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 12.6640 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 12.6040 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 11.2310 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 12.8260 9.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 10.0820 8.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 15.1950 6.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 15.1770 7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 14.8080 8.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 7.5650 5.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 8.5950 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 6.4740 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 5.6820 6.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 6.6900 6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 7.9710 6.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 4.0920 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 4.4410 5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 7.5650 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 7.1330 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 5.1960 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 5.8420 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 5.1480 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 5.5450 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 3.4030 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 2.0940 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 3.7990 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 3.0550 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 2.0510 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 5.0760 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 6.3620 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 6.6200 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 8.1740 3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 8.7830 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 9.4820 4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 2.4740 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 3.3700 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 2.0820 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 37 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 9 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 12 15 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 53 1 0 0 0 0 15 18 1 0 0 0 0 16 54 1 0 0 0 0 17 55 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 22 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 25 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 34 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 29 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 39 1 0 0 0 0 29 30 1 0 0 0 0 29 36 1 0 0 0 0 30 31 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 31 32 1 0 0 0 0 31 37 1 0 0 0 0 31 73 1 0 0 0 0 32 33 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 37 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 37 38 1 0 0 0 0 38 86 1 0 0 0 0 M END > 469 $$$$ 470 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6810 1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6020 -1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -6.2850 2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.7230 2.4870 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3880 -4.8590 2.5360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0030 -4.4180 3.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -4.7400 4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.8340 4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.2650 2.4270 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8550 -4.5860 3.6700 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5010 -4.5970 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -5.4460 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -5.1920 6.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -5.3000 6.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -5.4020 7.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -2.3200 3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -3.3380 3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1310 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -9.1590 2.5500 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3620 -8.4560 2.6280 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5700 -6.9440 2.5110 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2450 -6.6510 1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -7.2420 1.1770 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4120 -8.7660 1.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7390 -8.7570 3.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -10.5740 2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -6.8390 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -5.4280 -0.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -9.3590 1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -2.3050 3.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -4.5250 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -4.9250 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -5.5480 6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -1.3240 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -3.2960 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.4760 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.4520 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -8.8520 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -8.8000 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -6.5940 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -6.8970 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -9.1170 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -8.3440 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -10.8920 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -7.3600 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -7.1060 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -5.1010 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 -10.3250 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -1.3470 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 20 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 6 20 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 28 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 25 46 1 0 0 0 0 26 31 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END > 470 $$$$ 471 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 91 0 0 1 0 0 0 0 0999 V2000 2.6750 3.4140 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 2.1500 0.4690 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1250 1.1130 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 3.0690 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 2.1240 1.8730 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6100 0.8690 1.7180 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9500 -0.1470 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -0.6050 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 1.6700 1.7380 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3430 0.5980 2.7270 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3480 2.3750 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 2.8160 1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 0.8650 1.3240 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7680 0.1560 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 -0.8300 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6760 -1.2810 2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0340 0.5400 1.3180 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4940 -0.0140 2.6610 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9830 -0.3520 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2860 -1.3590 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 -0.7830 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -0.4150 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7280 0.4440 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1160 -1.8520 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5530 1.4940 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2590 1.0110 3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6680 0.4550 5.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 0.4190 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 1.0860 4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 2.8860 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 1.5170 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -0.2030 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 2.4860 0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 2.8090 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 3.1690 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 2.8110 -1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 0.4000 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 1.2050 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 4.1080 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 3.9080 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 1.7160 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 2.5760 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 3.9810 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 0.2740 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -1.0270 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -1.3320 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -1.0650 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6800 2.8310 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9890 2.7700 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 3.5150 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8880 3.3710 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -1.3420 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 -1.7360 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 -1.9820 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5670 0.5560 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2540 -0.7890 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3560 -1.5830 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7370 -2.2840 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8200 -1.3380 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 0.0580 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7800 0.1620 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4230 0.8390 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5830 1.2070 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5120 -2.7310 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8320 -1.4530 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1700 -2.1300 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 1.9110 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 1.2640 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5480 1.0500 5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 0.7830 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9500 -0.6690 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 0.8270 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8940 0.3500 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 2.0370 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 1.2180 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 3.4520 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 2.1820 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 3.5710 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 1.5810 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 0.7720 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 2.4880 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -0.5070 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -0.9830 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -0.0440 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 3.1120 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 4.1820 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 2.4720 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 41 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 38 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 26 27 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 M END > 471 $$$$ 472 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4420 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 3 0 0 0 0 0 0 0 0 0 1.3640 -0.4950 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 0.6810 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 1.8970 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 1.3630 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 0.0340 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -0.6290 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 2.0020 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 1.3300 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.0190 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -0.7250 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 2.0020 1.3520 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7820 3.0970 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 4.0940 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 3.5120 1.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6450 2.0290 3.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 3.3900 4.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -0.6100 3.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 1.7930 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 1.8440 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 3.8440 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 5.0080 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 5.7260 1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 5.4200 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -0.6880 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -1.3930 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 0.6790 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.6290 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -1.6600 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 3.0340 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -1.0030 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -1.6400 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 3.3950 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 4.5250 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 4.8920 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 3.9460 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 3.9680 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 3.8020 4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 3.4390 4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -0.5340 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 4.6520 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 5.5420 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 6.3640 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 11 2 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 16 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 22 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END > 472 $$$$ 473 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 48 0 0 1 0 0 0 0 0999 V2000 -0.0430 1.4770 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0400 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -0.5120 0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -0.0780 0.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5640 -0.5240 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 1.3390 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 0.0550 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -0.6730 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 -0.1230 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 1.1560 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 1.8910 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 2.1220 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 1.4230 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 2.1010 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 3.5090 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 4.1880 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 3.4850 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 4.3640 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 5.6630 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 5.5130 -0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 4.2030 -0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 4.6880 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -1.3160 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -1.6370 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.7810 2.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 1.8040 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.8140 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.4260 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.4040 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.5320 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -0.1820 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -1.6120 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -1.6710 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -0.6940 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3090 1.5800 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 2.8890 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 5.9170 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 6.4200 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 5.2230 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 3.8480 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 5.3630 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -1.0560 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -2.7000 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -1.3870 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 30 1 0 0 0 0 5 7 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 17 2 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END > 473 $$$$ 474 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.7240 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.0370 -2.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.6830 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -1.9390 -1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.0260 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2420 1.1690 0.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 1.0490 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 0.1800 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 1.6380 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 4.4410 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 5.7780 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 6.5650 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 7.8910 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 8.8600 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 8.1780 1.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.9990 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 3.4680 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 4.3990 -1.2770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4340 3.4290 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 4.0560 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8500 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -0.5540 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -1.7620 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.1530 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 2.0040 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -0.8460 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 0.2060 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 0.5490 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 6.3460 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 5.6100 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 5.9980 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 6.7330 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 8.4300 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 9.7920 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 9.0570 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 1.7680 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 1.4290 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 3.6870 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 3.6740 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 5.4230 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 3.6050 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 4.1340 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 4.7490 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 3.0370 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 18 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 5 2 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 M END > 474 $$$$ 475 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.7240 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.0370 -2.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.6830 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -1.9390 -1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.0260 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2420 1.1690 0.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 1.0490 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 0.1800 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 1.6380 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 4.4410 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 5.7780 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 6.5650 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 7.8910 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 8.8600 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 8.1780 1.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.9990 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 3.4680 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 4.3990 -1.2770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4340 3.4290 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 4.0560 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -0.8140 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8500 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -1.7620 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.1530 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 2.0040 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.8360 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 0.5770 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 0.1680 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 6.3460 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 5.6100 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 5.9980 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 6.7330 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 9.1290 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 9.7560 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 8.3940 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 1.7680 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 1.4290 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 3.6870 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 3.6740 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 5.4230 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 3.6050 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 4.1340 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 4.7490 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 3.0370 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -1.4340 -2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -1.4500 -3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -0.1400 -3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 18 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 5 2 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 23 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 M END > 475 $$$$ 476 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3940 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 2.1080 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4360 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0300 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -0.6190 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 0.0500 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 1.4590 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 2.1720 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6830 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6620 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -2.0380 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.7620 0.4110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2620 -2.1890 -0.0380 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2580 -2.5460 1.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -3.5190 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.3650 4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -4.5180 2.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -2.6430 -1.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -2.7940 -1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -3.2510 -3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -3.4000 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -3.1010 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -3.5500 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -0.5770 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.6580 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -2.1570 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -2.5530 -0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9150 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 3.1880 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 1.9700 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 3.2520 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -3.8290 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -2.5320 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -3.7720 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -3.9040 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -2.3090 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.7360 -4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 -3.2800 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -2.0590 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -3.7480 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -2.6470 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -4.3270 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -3.8920 -3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -2.1290 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -3.7080 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -2.5800 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -1.7220 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.2080 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -1.6250 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 14 19 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 28 2 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END > 476 $$$$ 477 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 106113 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.5730 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -0.1240 -1.2070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1470 1.4060 -1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 1.9530 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6860 1.8860 1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3810 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 1.8350 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.6090 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 0.2060 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 1.5400 1.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8260 2.6610 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 -9.5730 -2.2310 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 0.7520 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 1.2250 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 2.4600 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -0.3190 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0900 0.1940 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5970 -1.5150 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -0.1670 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 1.6120 4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 3.4210 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 3.8930 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 2.2320 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 3.5680 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 4.6810 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 4.1650 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6180 -2.1300 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2860 -2.7470 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -1.0660 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1740 -5.0200 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 -5.2090 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 39 42 1 0 0 0 0 40 42 1 0 0 0 0 40 97 1 0 0 0 0 41 42 1 0 0 0 0 41 45 1 0 0 0 0 41 98 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 43 46 1 0 0 0 0 43 99 1 0 0 0 0 44 45 1 0 0 0 0 44 47 1 0 0 0 0 44 48 1 0 0 0 0 46100 1 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 48104 1 0 0 0 0 48105 1 0 0 0 0 48106 1 0 0 0 0 M END > 477 $$$$ 478 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 98101 0 0 1 0 0 0 0 0999 V2000 -2.0680 4.5130 6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 3.2620 6.2920 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0750 1.9900 6.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 4.5890 5.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 3.3720 5.1940 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0120 2.0930 5.1890 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0450 0.9090 5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.9090 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 2.2900 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 4.8320 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 4.7790 3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 3.5420 2.3770 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9320 2.3830 2.1610 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8830 1.2020 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 1.8190 0.9590 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9210 3.3470 1.2220 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5150 1.6890 7.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 0.8300 5.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 3.4650 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 3.3800 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 3.8280 1.6400 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3210 3.4910 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 3.8580 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 5.3190 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 6.0180 1.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 2.6010 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.5310 -0.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 0.4160 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -0.2960 -0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 0.0510 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 5.8700 2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 3.4080 -0.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5120 4.1720 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 3.6950 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8480 5.6500 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4060 3.5940 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 3.2010 7.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 3.7920 7.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 3.4040 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 3.7700 8.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 4.3430 6.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 3.2040 -0.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 2.0640 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 5.3950 6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 4.5260 7.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 3.3080 5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 4.6050 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 5.4990 5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 0.9670 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -0.0310 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 0.2620 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.5090 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 5.0280 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 5.6680 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 5.3330 4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 5.3100 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 0.8570 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 0.3850 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 1.4150 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 3.8860 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 1.4980 8.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 0.8110 7.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 2.5440 7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 1.0250 4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -0.1040 5.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 0.7490 6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 3.5890 7.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 2.5520 6.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 4.3200 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 3.3470 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 2.4530 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 4.2230 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 3.3310 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 2.4240 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 4.0570 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 4.9380 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9380 3.3610 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 3.5320 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 2.6560 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.7700 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 0.8050 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 0.0040 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -0.9210 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 6.8310 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 2.3390 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 4.0740 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2940 4.7700 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3130 3.1990 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8940 5.7480 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 6.1950 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 6.0610 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 2.5110 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 4.0170 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4460 3.8440 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 3.2330 9.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 4.7920 8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 3.2690 8.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0380 3.3520 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 46 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 51 1 0 0 0 0 8 52 1 0 0 0 0 9 13 1 0 0 0 0 9 39 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 10 54 1 0 0 0 0 11 39 1 0 0 0 0 11 55 1 0 0 0 0 11 56 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 59 1 0 0 0 0 16 21 1 0 0 0 0 16 60 1 0 0 0 0 17 61 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 18 66 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 19 69 1 0 0 0 0 20 70 1 0 0 0 0 20 71 1 0 0 0 0 20 72 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 73 1 0 0 0 0 22 23 1 0 0 0 0 22 74 1 0 0 0 0 22 75 1 0 0 0 0 23 32 1 0 0 0 0 23 76 1 0 0 0 0 23 77 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 26 78 1 0 0 0 0 26 79 1 0 0 0 0 26 80 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 81 1 0 0 0 0 30 82 1 0 0 0 0 30 83 1 0 0 0 0 31 84 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 85 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 33 86 1 0 0 0 0 34 42 1 0 0 0 0 34 87 1 0 0 0 0 34 88 1 0 0 0 0 35 89 1 0 0 0 0 35 90 1 0 0 0 0 35 91 1 0 0 0 0 36 92 1 0 0 0 0 36 93 1 0 0 0 0 36 94 1 0 0 0 0 37 38 1 0 0 0 0 38 40 1 0 0 0 0 38 41 2 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 42 98 1 0 0 0 0 M END > 478 $$$$ 479 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2830 0.8320 -0.0060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1070 0.8870 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 1.6660 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 1.7200 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 2.4990 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 2.5530 3.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 3.3320 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 3.3860 4.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.7290 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -1.5190 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -2.1490 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.8880 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -3.5180 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -4.3080 0.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2770 -5.0220 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -3.4250 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4690 -4.8660 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9460 -3.9390 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 -3.0810 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 -5.0880 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -0.5110 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 0.8810 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 1.3850 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -0.1270 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 1.1680 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 2.6790 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 2.2180 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 0.7070 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 2.0010 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 3.5120 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 3.0510 4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 1.5400 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2080 2.8340 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 4.3460 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3760 3.9410 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 3.8840 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6980 2.3730 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -1.3920 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 0.0020 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 -5.0400 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -5.6630 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7300 -5.3780 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 -4.2250 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -2.0830 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1110 -3.0140 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0380 -3.5260 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 3 0 0 0 0 13 14 1 0 0 0 0 14 15 3 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 42 1 0 0 0 0 17 19 2 0 0 0 0 17 43 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 M END > 479 $$$$ 480 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3940 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0370 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 1.8450 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 3.2350 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 4.0150 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 1.2280 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 1.9930 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 3.3950 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 4.1860 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 3.4760 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 2.1160 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.4060 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 5.3700 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 5.4060 0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 3.8270 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -0.6280 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 0.1650 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 4.1030 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 5.9720 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 5.3100 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 7.4730 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 -0.3310 0.0360 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4000 -0.7300 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 -2.1350 -1.2940 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4900 -2.8870 -1.2150 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.1920 -2.5300 0.0980 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.3780 -1.0110 0.1680 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1830 1.0880 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4790 -2.4400 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 -4.2950 -1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4690 -3.1700 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9670 -0.6590 1.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -1.8330 -2.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -2.0590 -3.8670 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1710 -3.4520 -3.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -3.9900 -2.9170 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0530 -3.2750 -2.8460 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2870 -1.7710 -2.6760 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1520 -1.2660 -3.8350 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4530 -1.4490 -5.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.0880 -2.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -5.4860 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -3.7720 -1.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7540 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 1.9750 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 0.1500 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 4.0110 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 0.7890 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 -0.4890 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 0.7980 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0810 3.1720 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 4.7740 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 4.5740 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 7.7630 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 7.8200 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 7.9210 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 -0.6260 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5120 -2.4530 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1210 -2.5990 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -2.8620 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0270 -0.6850 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -3.5190 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -2.0420 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0480 -4.8340 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9700 -2.9860 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1130 0.2900 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -1.7330 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -3.8440 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -3.4550 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -1.5870 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.2080 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -1.1500 -5.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.1290 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -5.6320 -4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -5.8970 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -5.9950 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -4.7200 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 49 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 50 1 0 0 0 0 6 51 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 12 2 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 17 23 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 32 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 29 65 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 30 66 1 0 0 0 0 31 36 1 0 0 0 0 31 67 1 0 0 0 0 33 37 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 43 1 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 46 1 0 0 0 0 40 74 1 0 0 0 0 41 42 1 0 0 0 0 41 47 1 0 0 0 0 41 75 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 42 76 1 0 0 0 0 43 44 1 0 0 0 0 43 77 1 0 0 0 0 44 78 1 0 0 0 0 45 79 1 0 0 0 0 46 80 1 0 0 0 0 46 81 1 0 0 0 0 46 82 1 0 0 0 0 47 83 1 0 0 0 0 M END > 480 $$$$ 481 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 0.1500 2.1820 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.6810 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.0360 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 0.1230 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -1.4780 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -3.6250 -0.3030 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7120 -4.2700 -0.3080 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4130 -3.9550 1.0160 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4770 -2.4370 1.2030 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1550 -1.8970 1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -2.1200 -0.0660 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6860 -3.8510 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -5.6850 -0.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -4.4900 0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -2.1360 2.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 -0.8280 2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 0.1430 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 1.4800 2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.4730 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 0.8580 4.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 1.8440 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 3.2530 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 3.5720 5.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3430 2.4560 5.5440 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6760 1.1990 5.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 4.8320 5.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 4.1190 2.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 2.4310 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -1.5410 4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -1.8020 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -3.0190 6.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 -4.1360 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -3.3020 7.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 2.7050 6.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8910 3.3700 7.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2360 3.5990 8.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 3.1610 9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 2.4940 9.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 2.2730 7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 3.3850 10.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.5010 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 2.6330 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 2.4990 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -1.8570 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -1.7240 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -4.0630 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -3.8680 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -4.4000 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 -1.9970 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -1.6760 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -4.7860 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -6.1580 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 -4.3270 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -0.1460 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 3.5980 5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 2.4440 4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 5.5740 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 2.7670 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 -2.4580 4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 -1.2080 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -0.9850 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -4.5410 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -4.9240 5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -3.7520 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -3.1790 6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -4.3240 7.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -2.6070 7.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 3.7100 6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 4.1180 8.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 2.1530 10.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 1.7540 7.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4080 4.2200 11.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 5 11 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 18 21 2 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 24 56 1 0 0 0 0 26 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 40 72 1 0 0 0 0 M END > 481 $$$$ 482 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 90 0 0 1 0 0 0 0 0999 V2000 -0.0410 1.5500 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.0700 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -0.4200 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -1.9230 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 2.1520 0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 2.2010 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 9.6030 -2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 7.9680 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 9.2410 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 8.6370 -1.4870 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6320 7.3980 -2.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7620 8.3370 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 7.8340 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 6.6750 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 6.3510 -1.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6420 5.7820 -0.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5080 4.3770 0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1770 3.6450 0.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0420 4.3420 -0.5040 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4470 5.2630 -1.6240 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1340 10.1670 -3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 10.4660 -3.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 9.0920 -0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 8.6620 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 4.4470 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 5.1250 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 4.2080 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 5.4480 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 3.2120 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 5.2820 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 6.0820 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 4.7820 -0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 7.9810 2.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -2.4130 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -3.9160 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -4.4060 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -5.9090 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 -6.3990 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -7.9020 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -0.4580 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -0.1250 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 0.1070 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.2260 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.4500 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.1180 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 7.4510 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 6.9540 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 9.2450 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 7.5710 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 6.3570 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 6.8180 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 5.7320 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 3.7550 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 3.5980 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 5.7230 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 10.0670 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 11.1960 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 9.9090 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 9.9520 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 9.6280 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 8.8120 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 5.1040 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 3.6700 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 3.9870 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 6.2210 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 5.8180 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 5.1860 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 2.5230 2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 3.7510 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 2.6500 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 6.4520 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 5.4490 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 6.9260 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 8.4570 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -1.8860 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -2.2180 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -4.4430 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -4.1110 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 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1 0 0 0 0 17 27 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 54 1 0 0 0 0 20 25 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 23 59 1 0 0 0 0 24 33 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 33 74 1 0 0 0 0 34 35 1 0 0 0 0 34 75 1 0 0 0 0 34 76 1 0 0 0 0 35 36 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 36 37 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 37 38 1 0 0 0 0 37 81 1 0 0 0 0 37 82 1 0 0 0 0 38 39 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 39 85 1 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 M END > 482 $$$$ 483 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 91 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4490 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 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19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 27 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 25 32 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 28 1 0 0 0 0 26 30 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 M END > 485 $$$$ 486 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 0.3880 0.0570 -0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -1.2650 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -1.4600 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.1800 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 0.7200 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 1.6080 0.9440 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3610 1.3230 -1.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 0.1190 -0.4230 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3760 -0.6610 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5400 0.3200 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1710 1.3870 1.4960 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0960 0.1010 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 1.0720 1.0780 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8490 2.1190 1.2260 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5300 3.0530 2.4000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1320 3.5980 2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 2.5960 2.0620 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3630 0.4080 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 2.1970 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 3.3120 -0.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 0.4680 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 3.3280 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 4.7840 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 4.1520 2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7630 4.6810 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7370 5.8260 3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 4.2380 4.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6180 1.1730 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 2.1380 2.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0270 2.9560 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1920 3.8100 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4900 4.6140 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 5.5280 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 4.6040 -1.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -2.0410 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -2.4110 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 1.7940 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 -0.7320 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6030 -1.3740 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 -1.2000 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4240 -0.2220 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7600 0.7880 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 0.6240 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 -0.6260 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 2.5050 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 2.0480 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -0.4460 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 0.6710 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 3.8800 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 2.6030 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 4.0220 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 6.7700 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 5.7820 4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4720 5.7530 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 1.5420 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 0.2690 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1640 2.2940 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 3.5730 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5640 5.0110 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4990 6.4210 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8580 5.8140 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 37 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 18 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 22 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END > 486 $$$$ 487 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 203213 0 0 1 0 0 0 0 0999 V2000 2.0360 2.5340 3.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 1.9980 4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 0.8830 5.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.4080 3.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 9.1000 7.0860 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8910 8.8950 5.7340 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0030 7.6520 5.9670 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6440 6.9380 7.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 7.9570 7.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 10.3710 7.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 10.0330 5.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1260 8.9750 6.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 9.1690 8.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 6.8430 4.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 22.8100 3.4300 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8990 22.4190 2.0930 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6290 21.1990 1.5260 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0170 21.5030 1.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 21.8300 2.6010 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0300 23.0750 3.2120 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1570 22.1070 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 20.9110 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 23.3710 4.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 23.9920 3.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 22.0990 2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 20.8620 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 5.7990 4.8360 C 0 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CORINA evaluation license 3.40 0067 02.08.2006 203213 0 0 1 0 0 0 0 0999 V2000 -4.3160 2.0510 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 0.8170 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 0.9120 0.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -0.2580 -0.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 6.6500 9.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 5.0460 7.3840 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0520 3.6040 7.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9120 3.7940 6.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3870 5.1110 6.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 5.9350 6.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8430 5.2690 7.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 2.8930 6.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 5.3130 8.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 2.8050 6.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.4370 -2.2140 4.7020 C 0 0 2 0 0 0 0 0 0 0 0 0 -18.8220 -3.5850 4.4070 C 0 0 2 0 0 0 0 0 0 0 0 0 -17.4870 -3.7060 5.1470 C 0 0 1 0 0 0 0 0 0 0 0 0 -17.7020 -3.5160 6.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.2320 -2.2340 6.8880 C 0 0 1 0 0 0 0 0 0 0 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64 1 0 0 0 0 60100 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 61155 1 0 0 0 0 61156 1 0 0 0 0 62 79 1 0 0 0 0 62157 1 0 0 0 0 63 64 1 0 0 0 0 63 67 1 0 0 0 0 63 80 1 0 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 65158 1 0 0 0 0 66 68 1 0 0 0 0 66159 1 0 0 0 0 66160 1 0 0 0 0 67 68 1 0 0 0 0 67 70 1 0 0 0 0 67 81 1 0 0 0 0 68 72 1 0 0 0 0 68161 1 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 69162 1 0 0 0 0 69163 1 0 0 0 0 70164 1 0 0 0 0 70165 1 0 0 0 0 71 72 1 0 0 0 0 71 76 1 0 0 0 0 71166 1 0 0 0 0 72 73 1 0 0 0 0 72 82 1 0 0 0 0 73 74 1 0 0 0 0 73167 1 0 0 0 0 73168 1 0 0 0 0 74 75 1 0 0 0 0 74 87 1 0 0 0 0 74169 1 0 0 0 0 75 76 1 0 0 0 0 75 88 1 0 0 0 0 75170 1 0 0 0 0 76 83 1 0 0 0 0 76 84 1 0 0 0 0 77171 1 0 0 0 0 77172 1 0 0 0 0 77173 1 0 0 0 0 78174 1 0 0 0 0 78175 1 0 0 0 0 78176 1 0 0 0 0 79177 1 0 0 0 0 80178 1 0 0 0 0 80179 1 0 0 0 0 80180 1 0 0 0 0 81181 1 0 0 0 0 81182 1 0 0 0 0 81183 1 0 0 0 0 82184 1 0 0 0 0 82185 1 0 0 0 0 82186 1 0 0 0 0 83 85 1 0 0 0 0 83187 1 0 0 0 0 83188 1 0 0 0 0 84 86 1 0 0 0 0 84189 1 0 0 0 0 84190 1 0 0 0 0 85191 1 0 0 0 0 86192 1 0 0 0 0 87193 1 0 0 0 0 88 90 1 0 0 0 0 89 90 1 0 0 0 0 89 97 1 0 0 0 0 89 98 1 0 0 0 0 89194 1 0 0 0 0 90 91 1 0 0 0 0 90195 1 0 0 0 0 91 92 1 0 0 0 0 92 93 1 0 0 0 0 92 94 1 0 0 0 0 92196 1 0 0 0 0 93 96 1 0 0 0 0 93 98 1 0 0 0 0 93197 1 0 0 0 0 94 95 1 0 0 0 0 94198 1 0 0 0 0 94199 1 0 0 0 0 95200 1 0 0 0 0 96201 1 0 0 0 0 97202 1 0 0 0 0 98203 1 0 0 0 0 M END > 488 $$$$ ATCMD MOE2008 3D 80 83 0 0 1 0 0 0 0 0999 V2000 -4.3910 1.3080 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 1.5830 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 2.3350 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 3.2110 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 2.6770 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 0.1270 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -0.4150 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -1.4130 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 0.2020 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -0.5450 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -1.3210 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -0.9400 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 1.9130 0.8960 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7820 0.7760 -0.2480 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3370 1.0420 0.2370 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1120 2.3740 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 2.9030 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 2.4010 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 3.1140 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 3.6600 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 3.8240 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 -0.7790 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 1.2790 -1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 0.1320 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 1.1510 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 1.0700 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 1.7780 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.8450 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 2.2900 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 1.8430 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 3.1940 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 3.4890 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 4.4390 0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 4.0320 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 3.4890 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 4.9430 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 4.3550 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 1.5900 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.0340 2.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 0.5070 0.9900 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7040 1.8770 3.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -1.0140 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -1.5060 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -1.2390 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -1.4750 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 0.8380 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -0.4600 -2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.5300 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.5220 -3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -1.2950 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 1.4840 -3.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -1.8410 2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 -0.3820 2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4780 0.6230 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5590 0.4590 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 0.5430 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 1.6150 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 2.6870 -0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -0.4270 -2.3720 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4860 -0.4140 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -0.8140 -1.7320 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3500 -0.9820 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 0.9450 -3.0460 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1790 0.9010 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 1.9300 -2.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 1.6260 -1.4660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8200 1.5810 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 0.2650 -0.7500 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3720 0.2800 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -2.0580 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -2.6650 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 -0.0860 -0.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 -1.0370 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 1.4280 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 0.8760 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 2.4970 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 1.2290 -2.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7230 -3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 -1.4420 -3.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -1.3100 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 6 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 52 2 0 0 0 0 22 53 1 0 0 0 0 23 46 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 25 40 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 38 39 1 0 0 0 0 38 41 2 0 0 0 0 39 40 1 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 46 47 1 0 0 0 0 46 51 2 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 58 66 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 63 1 0 0 0 0 59 79 1 0 0 0 0 61 62 1 0 0 0 0 61 68 1 0 0 0 0 61 70 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63 74 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 68 69 1 0 0 0 0 68 72 1 0 0 0 0 70 71 1 0 0 0 0 72 73 1 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 74 77 1 0 0 0 0 77 78 1 0 0 0 0 79 80 1 0 0 0 0 M END > 489 $$$$ 490 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 1.9350 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -0.4850 -0.0370 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7180 0.7640 -0.0390 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6040 0.7840 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 3.1070 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 -1.2590 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7730 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.5950 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 2.1140 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 2.3540 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 3.0610 1.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 3.3520 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 4.0840 2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 3.0260 3.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.7630 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -1.0840 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 0.7870 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 -0.1040 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 1.6750 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 0.7970 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -2.0490 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -0.9530 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -1.7270 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -0.1960 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.9530 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 3.9760 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 3.9450 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 3.0710 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 1.5160 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.3970 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.9520 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 3.3630 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 4.6820 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 4.7370 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 14 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 M END > 490 $$$$ 491 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.1310 1.1980 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 1.9620 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 3.3350 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 3.9550 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 3.1970 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 1.8270 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -4.5310 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -5.1690 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -4.4260 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -3.1470 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.3850 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -3.0280 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -2.2000 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -0.7910 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.2680 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -1.0370 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -5.2700 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -5.0480 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -2.7050 -0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 0.0300 -0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 5.3060 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 4.0810 -2.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 0.6740 1.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 2.0400 1.7180 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6160 2.8130 1.3790 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2960 2.1550 0.1740 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5760 0.6840 0.5000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2610 -0.0060 0.8730 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5270 2.8250 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 2.6550 2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 0.6020 1.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -0.4320 1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3490 -0.5830 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -1.2400 0.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 4.1660 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 1.4800 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 3.6830 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 1.2390 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -6.2480 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -2.6630 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -5.5030 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -5.2480 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 5.7780 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 4.2130 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 2.0940 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 2.7940 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 2.2180 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 0.1950 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -1.0420 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 3.7640 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 2.6010 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 3.6970 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 2.1040 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -0.6810 3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -1.4730 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 0.2940 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 4.6430 1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 12 2 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 20 28 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 35 57 1 0 0 0 0 M END > 491 $$$$ 492 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7200 -0.4630 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.0450 -1.1850 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1480 1.4840 -1.2250 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5130 1.9070 -1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 3.4770 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.5120 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 2.0090 -1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 2.1940 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 2.6930 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 1.9610 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -0.5780 -2.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -4.6560 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -4.0890 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -2.7080 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -1.9300 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -2.4980 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -3.8800 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -6.1180 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -6.6760 -3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -8.0580 -3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -8.8440 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -8.2850 -1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -6.9040 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -4.4820 -4.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -5.7300 -4.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -6.3160 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -5.0230 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -4.6390 0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 -6.0630 -5.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -10.1960 -2.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -9.0900 -0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -1.7000 -4.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.4070 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.7280 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.8460 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 1.5850 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 3.8760 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.1610 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.6020 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.1350 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 2.8460 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 1.9570 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 3.6360 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -2.2470 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -8.5140 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -10.5460 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -9.2760 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -1.4250 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 10 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 33 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 28 32 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 M END > 492 $$$$ 493 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 76 80 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.3560 0.7310 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7040 2.2680 -1.4450 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7580 3.1290 -2.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 4.4150 -1.4700 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1570 4.2480 -0.0260 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6690 3.1340 2.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 5.2560 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 5.5280 0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 2.8860 -1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 3.6070 -5.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3570 4.7230 -5.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 2.0630 -4.5100 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3640 1.8290 -3.1420 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5430 3.0640 -2.7600 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4530 4.2950 -2.7680 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0480 4.4370 -4.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 3.3330 -4.4510 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8390 0.9470 -4.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 0.6870 -3.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 6.0640 -3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 5.5240 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 6.1100 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 7.1940 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 7.7960 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 7.2520 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 7.9080 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 9.0560 0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 9.5030 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 8.8960 -1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 10.7010 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 7.4790 1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 5.5840 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 5.4830 -4.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 11.1850 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 12.3030 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 12.9500 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 12.4720 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 11.3510 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 14.0520 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.0780 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.3980 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -1.4070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 3.8410 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 1.3940 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 1.3200 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 4.9140 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 3.7850 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 3.9430 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 4.7560 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 6.2360 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 5.3740 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 6.1460 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 3.8300 -6.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0190 2.7290 -6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 4.9550 -6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 2.1820 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 1.6610 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 3.2030 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 4.1730 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 3.1980 -3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 1.0280 -5.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -0.1310 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 7.6040 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 9.5730 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4570 5.9430 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 4.8000 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 10.6830 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 12.6780 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 12.9780 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 10.9800 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 13.8600 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 51 1 0 0 0 0 10 13 1 0 0 0 0 10 52 1 0 0 0 0 11 53 1 0 0 0 0 12 54 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 13 57 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 58 1 0 0 0 0 15 59 1 0 0 0 0 16 60 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 17 61 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 20 64 1 0 0 0 0 21 22 1 0 0 0 0 22 65 1 0 0 0 0 23 66 1 0 0 0 0 24 67 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 27 30 2 0 0 0 0 27 37 1 0 0 0 0 28 29 2 0 0 0 0 28 68 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 69 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 35 39 1 0 0 0 0 35 43 2 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 39 40 2 0 0 0 0 39 72 1 0 0 0 0 40 41 1 0 0 0 0 40 73 1 0 0 0 0 41 42 2 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 42 74 1 0 0 0 0 43 75 1 0 0 0 0 44 76 1 0 0 0 0 M END > 493 $$$$ 494 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 76 80 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8080 -0.5020 1.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1280 0.0420 1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 1.4690 1.2020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4220 2.0470 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7070 2.0030 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 1.9350 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 3.4960 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -0.0840 2.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.8330 7.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.8980 8.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -2.4320 5.2850 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1400 -1.9340 3.9710 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7820 -0.5940 3.5990 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5750 0.3980 4.7470 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1370 -0.1400 5.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -1.3690 6.3680 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1060 -3.6460 5.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.8870 2.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 1.8010 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 1.7010 4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 2.7940 4.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 2.9930 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 4.0990 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 4.0010 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 5.1900 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 6.3650 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 6.3570 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 5.2670 3.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 7.5920 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 5.1610 3.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 2.6990 3.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 0.7230 4.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 7.6150 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 8.7700 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 9.9120 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 9.8940 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 8.7420 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 11.0500 1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 4.1440 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 5.6500 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 3.5210 -1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -0.4670 -1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8800 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.3820 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -1.5910 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 1.8140 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 1.7350 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 1.7060 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 1.5910 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 3.0240 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 1.5230 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -1.8970 7.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -2.8140 7.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -1.1290 9.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -2.6110 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -1.8020 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.7360 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 0.5700 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -1.2200 6.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -4.0190 6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -3.7620 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 3.0590 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 7.2630 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 2.9210 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 0.1560 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 6.7280 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 8.7880 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 10.7840 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 8.7280 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 11.1280 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 5.9650 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 6.0190 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 6.0530 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.4300 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 48 1 0 0 0 0 6 9 1 0 0 0 0 6 49 1 0 0 0 0 7 50 1 0 0 0 0 8 51 1 0 0 0 0 8 52 1 0 0 0 0 8 53 1 0 0 0 0 9 41 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 54 1 0 0 0 0 11 55 1 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 59 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 60 1 0 0 0 0 17 18 1 0 0 0 0 18 61 1 0 0 0 0 19 62 1 0 0 0 0 20 63 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 26 2 0 0 0 0 23 33 1 0 0 0 0 24 25 2 0 0 0 0 24 64 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 35 1 0 0 0 0 31 39 2 0 0 0 0 33 66 1 0 0 0 0 34 67 1 0 0 0 0 35 36 2 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 40 72 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 42 75 1 0 0 0 0 44 76 1 0 0 0 0 M END > 494 $$$$ 495 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 69 73 0 0 1 0 0 0 0 0999 V2000 0.1150 1.5410 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 0.1650 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -0.4310 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 0.3490 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 1.7250 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.3210 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 2.1910 -0.0210 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1360 3.4560 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 3.0340 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 1.6780 4.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 0.7490 3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 1.1760 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 2.5280 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 2.9910 1.2740 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8070 2.9660 1.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 4.4790 0.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3600 3.1780 -1.1910 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6330 4.5720 -0.5850 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1500 4.1860 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 5.1770 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 6.4980 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 6.8670 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 5.9040 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 4.5450 2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.2600 5.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -0.1500 5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 7.4360 1.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 8.7810 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 6.2600 4.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 7.6400 4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 4.9320 1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 4.8940 -0.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 2.7830 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 3.5120 -3.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 1.8090 -1.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 5.5580 -1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 5.9270 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 5.8600 -2.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 3.0720 -3.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -0.4440 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -1.5060 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -0.1170 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 2.3340 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.3960 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 1.4290 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 4.5110 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 3.7590 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.3070 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 0.4530 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 3.1890 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 5.3270 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 7.8980 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 3.8160 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.6110 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -0.5700 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -0.3460 6.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 8.8250 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 9.4250 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 9.1180 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 7.9450 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 8.2410 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 7.7870 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 5.8720 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 6.5680 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 6.4580 -2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 5.0220 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 3.7480 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 2.0630 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 3.0770 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 44 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 19 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 50 1 0 0 0 0 18 32 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 39 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 M END > 495 $$$$ 496 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 111116 0 0 1 0 0 0 0 0999 V2000 1.7460 3.6610 -5.4690 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0620 2.3030 -6.1010 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5400 2.2670 -6.5040 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4010 2.5470 -5.2680 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9940 3.8960 -4.6680 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6030 3.8720 -4.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 4.1380 -3.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 3.6830 -5.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 4.9900 -4.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 0.9770 -7.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 2.5880 -5.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 2.1150 -7.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 5.3890 -1.5380 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6150 5.4650 -2.9610 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9690 6.1700 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 6.7980 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 7.4350 -0.8940 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9540 7.4870 -2.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3150 8.1800 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 9.6560 -1.8390 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2220 8.8820 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 9.7340 -0.4520 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8940 10.7510 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 9.3490 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 5.2320 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2430 6.4640 -4.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 6.6880 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 10.1940 2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 11.2070 1.1370 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2860 11.1640 0.0500 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5970 11.7420 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 13.1830 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 12.6190 1.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3710 13.2300 2.1580 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8410 14.6440 2.5050 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5250 14.3360 3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 12.9090 2.8270 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7730 12.8900 2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 15.3530 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 15.6170 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 16.6830 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3720 10.3080 -1.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 12.0360 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 12.6230 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 9.2600 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 4.7770 -1.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 4.1430 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 4.1760 0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 3.3880 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 12.7860 4.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 4.4500 -6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 1.5100 -5.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 3.0280 -7.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 1.7590 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 4.6880 -5.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 3.4240 -5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 2.9600 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 5.0590 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 0.8830 -7.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 2.7620 -4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 1.2730 -7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 4.7740 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 6.0090 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 7.3970 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 6.7410 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 8.1720 -2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 7.7120 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 8.1550 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4490 10.0940 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 11.4200 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 10.7290 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 8.7110 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1520 4.3820 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 5.7680 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 4.8780 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 7.0400 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 7.0350 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 5.5240 -5.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 5.6220 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 7.0640 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 6.8460 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 9.1820 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 10.3100 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 10.3690 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 11.1200 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3420 11.7400 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 13.5320 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1590 13.8420 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 13.2610 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 15.2120 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 14.3910 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 15.0330 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 12.2200 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 13.0680 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0100 14.7250 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 16.0380 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7360 16.3200 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 14.6800 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 16.4950 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 17.1900 4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 17.3120 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 10.2860 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 11.6570 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 13.0630 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 12.0080 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 11.5610 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8360 13.1260 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 3.3950 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 2.3590 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 3.8650 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 12.4230 5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 55 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 56 1 0 0 0 0 8 57 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 11 60 1 0 0 0 0 12 61 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 13 62 1 0 0 0 0 14 15 1 0 0 0 0 14 63 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 64 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 66 1 0 0 0 0 19 20 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 20 69 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 30 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 23 70 1 0 0 0 0 23 71 1 0 0 0 0 24 72 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 25 75 1 0 0 0 0 26 76 1 0 0 0 0 26 77 1 0 0 0 0 26 78 1 0 0 0 0 27 79 1 0 0 0 0 27 80 1 0 0 0 0 27 81 1 0 0 0 0 28 29 1 0 0 0 0 28 82 1 0 0 0 0 28 83 1 0 0 0 0 28 84 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 43 1 0 0 0 0 31 32 1 0 0 0 0 31 85 1 0 0 0 0 31 86 1 0 0 0 0 32 34 1 0 0 0 0 32 87 1 0 0 0 0 32 88 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 33 89 1 0 0 0 0 34 35 1 0 0 0 0 34 44 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 90 1 0 0 0 0 36 37 1 0 0 0 0 36 91 1 0 0 0 0 36 92 1 0 0 0 0 37 38 1 0 0 0 0 37 93 1 0 0 0 0 38 94 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 95 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 40 98 1 0 0 0 0 41 99 1 0 0 0 0 41100 1 0 0 0 0 41101 1 0 0 0 0 42102 1 0 0 0 0 43103 1 0 0 0 0 43104 1 0 0 0 0 43105 1 0 0 0 0 44 50 1 0 0 0 0 44106 1 0 0 0 0 44107 1 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 49108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 50111 1 0 0 0 0 M END > 496 $$$$ 497 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 78 82 0 0 1 0 0 0 0 0999 V2000 0.3740 2.6920 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 1.4000 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 0.9550 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 0.5950 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 4.4900 0.2380 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7730 3.0490 -0.2340 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1700 2.9390 -1.7090 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5310 3.3460 -1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 4.7000 -1.4840 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4490 4.8820 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6890 4.5860 1.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 6.2480 0.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 5.0320 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.7430 -8.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 0.9820 -8.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 0.5140 -7.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 2.0410 -6.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 1.5710 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 0.8020 -6.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 0.3520 -5.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 0.6130 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 1.3480 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.8650 -4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 1.5850 -2.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 2.5290 -3.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 2.7840 -6.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 0.6950 -9.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 0.0820 -3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -0.5740 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -1.0700 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -0.9180 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -0.2630 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 0.2300 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -1.4070 -0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 4.9750 -3.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 6.0320 -5.7310 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1160 5.0580 -4.9510 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8980 5.2700 -3.4510 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1860 6.6290 -3.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 7.5820 -3.7790 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5480 7.4640 -5.2930 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4860 5.3020 -5.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 8.3750 -5.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 5.8920 -7.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 8.9940 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -0.1150 -2.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 1.8130 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 0.2140 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 0.5140 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 5.1590 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 2.3750 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 3.5830 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 5.3680 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 4.2440 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 5.4730 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 6.4360 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 6.0340 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 4.3090 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 2.1060 -8.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -0.0770 -7.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 3.7360 -6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 1.3490 -10.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -0.6930 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -1.5770 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 0.7370 -4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 -2.3190 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 5.8140 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 4.0340 -5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 4.6100 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 7.3870 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 7.6980 -5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 4.7200 -4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 9.3030 -5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 5.0060 -7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 9.1880 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 9.7200 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 9.0780 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 -0.8420 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 3 49 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 51 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 53 1 0 0 0 0 10 12 1 0 0 0 0 10 54 1 0 0 0 0 11 55 1 0 0 0 0 12 56 1 0 0 0 0 13 35 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 19 2 0 0 0 0 16 60 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 2 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 46 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 41 1 0 0 0 0 36 44 1 0 0 0 0 36 67 1 0 0 0 0 37 38 1 0 0 0 0 37 42 1 0 0 0 0 37 68 1 0 0 0 0 38 39 1 0 0 0 0 38 69 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 45 1 0 0 0 0 40 70 1 0 0 0 0 41 43 1 0 0 0 0 41 71 1 0 0 0 0 42 72 1 0 0 0 0 43 73 1 0 0 0 0 44 74 1 0 0 0 0 45 75 1 0 0 0 0 45 76 1 0 0 0 0 45 77 1 0 0 0 0 46 78 1 0 0 0 0 M END > 497 $$$$ 498 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 128135 0 0 1 0 0 0 0 0999 V2000 5.0920 -3.3470 11.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -4.4210 10.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 -5.5230 10.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -4.2910 9.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -6.5150 9.3460 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0640 -7.5190 10.0440 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6560 -8.6050 9.0450 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8270 -9.2390 8.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 -8.3590 7.8240 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1960 -7.2620 8.7730 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9030 -9.1490 7.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 -10.0960 6.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 -6.3480 8.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -6.8440 10.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -9.5760 9.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -10.5770 8.8340 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9550 -10.1160 8.2870 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3590 -11.2270 7.4190 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2350 -12.4210 8.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -12.9250 8.6920 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1170 -11.8820 9.6110 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9300 -10.8260 6.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -14.2130 9.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -11.6480 10.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -8.9380 7.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -17.2580 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 -16.4580 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5560 -17.5170 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6210 -18.2570 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 -15.5050 0.9400 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6190 -16.3010 1.9560 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8640 -13.6030 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -14.7110 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1280 -14.2140 1.9970 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0690 -15.1320 2.7620 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5140 -15.5380 4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 -14.9330 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 -13.1240 2.9480 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7790 -13.8040 4.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1460 -11.1080 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -12.1130 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -11.8630 4.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0960 -12.8620 5.0190 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1100 -13.6930 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 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128135 0 0 1 0 0 0 0 0999 V2000 -9.3200 6.0950 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6090 5.3340 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8120 4.6060 2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4600 5.3790 0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0760 3.9000 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4020 2.2880 3.8470 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.4730 1.5690 5.1980 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.4160 2.6090 6.3210 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.1390 3.4400 6.1720 C 0 0 1 0 0 0 0 0 0 0 0 0 -12.1210 4.0560 4.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1250 3.1310 3.7930 C 0 0 2 0 0 0 0 0 0 0 0 0 -13.3810 1.3230 2.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6980 0.8370 5.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4090 1.9450 7.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1060 4.4490 7.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1630 8.8080 8.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1940 6.6270 7.7100 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.8980 5.2120 7.2040 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.8880 4.5470 8.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.6280 5.4120 8.2220 C 0 0 1 0 0 0 0 0 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11.4630 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9200 8.7280 12.3000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0480 7.7100 12.5950 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3130 8.4420 12.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 9.4410 11.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 10.3930 11.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 9.6250 11.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 3.6880 8.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 3.4580 10.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 5.7200 12.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 5.2440 12.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 7.4710 9.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 7.3180 10.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 11.3710 12.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 11.1940 10.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 9.3680 13.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 7.0680 13.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 6.9520 13.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 3.0510 7.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 5.6400 8.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 7.2980 9.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 -12.0170 7.4170 9.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9130 2.7730 8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2260 7.3450 9.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 6.1740 11.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 5.9620 8.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 7.6540 9.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 8.0540 11.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 3.6530 11.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 3.3330 9.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 4.1340 10.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 5.2730 9.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 9.3790 13.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 8.6390 12.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 5.1760 12.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 5.3000 10.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 6.0090 11.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 8.9590 13.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 7.7120 13.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 10.0410 12.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 8.9130 10.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 9.1030 10.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 10.3560 10.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 4.3800 7.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 2.9330 8.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 2.9700 10.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 2.7090 10.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 3.9750 11.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 5.4270 12.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 4.8610 12.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 6.5180 13.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 4.7620 12.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 5.9780 13.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 4.4930 12.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 8.2820 9.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 7.8760 9.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 6.7510 9.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 6.6880 9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 11.9490 12.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 12.0460 12.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 10.8180 13.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 10.5100 9.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 11.8820 9.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 11.7590 10.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 5.9140 13.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 7.4290 14.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 2.5440 6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 62 1 0 0 0 0 1 63 1 0 0 0 0 1 64 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 5 11 1 0 0 0 0 5 65 1 0 0 0 0 5 66 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 67 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 68 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 69 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 70 1 0 0 0 0 10 11 1 0 0 0 0 11 71 1 0 0 0 0 12 72 1 0 0 0 0 13 73 1 0 0 0 0 14 74 1 0 0 0 0 15 18 1 0 0 0 0 16 22 1 0 0 0 0 16 75 1 0 0 0 0 16 76 1 0 0 0 0 16 77 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 17 78 1 0 0 0 0 18 19 1 0 0 0 0 18 79 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 80 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 81 1 0 0 0 0 21 22 1 0 0 0 0 22 82 1 0 0 0 0 23 83 1 0 0 0 0 24 84 1 0 0 0 0 25 27 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 85 1 0 0 0 0 26 86 1 0 0 0 0 27 28 1 0 0 0 0 27 87 1 0 0 0 0 28 31 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 88 1 0 0 0 0 29 89 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 90 1 0 0 0 0 32 91 1 0 0 0 0 33 35 1 0 0 0 0 33 92 1 0 0 0 0 33 93 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 34 61 1 0 0 0 0 35 39 1 0 0 0 0 35 51 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 36 94 1 0 0 0 0 37 95 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38 57 1 0 0 0 0 39 40 1 0 0 0 0 39 52 1 0 0 0 0 40 41 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 41 43 1 0 0 0 0 41 53 1 0 0 0 0 41 98 1 0 0 0 0 42 43 1 0 0 0 0 42 47 1 0 0 0 0 42 56 1 0 0 0 0 43 44 1 0 0 0 0 43 58 1 0 0 0 0 44 45 1 0 0 0 0 44 99 1 0 0 0 0 44100 1 0 0 0 0 45 46 1 0 0 0 0 45101 1 0 0 0 0 45102 1 0 0 0 0 46 47 1 0 0 0 0 46 54 1 0 0 0 0 46 55 1 0 0 0 0 47103 1 0 0 0 0 47104 1 0 0 0 0 48 59 1 0 0 0 0 48105 1 0 0 0 0 48106 1 0 0 0 0 49107 1 0 0 0 0 49108 1 0 0 0 0 49109 1 0 0 0 0 50110 1 0 0 0 0 50111 1 0 0 0 0 50112 1 0 0 0 0 51113 1 0 0 0 0 51114 1 0 0 0 0 51115 1 0 0 0 0 52116 1 0 0 0 0 52117 1 0 0 0 0 52118 1 0 0 0 0 53119 1 0 0 0 0 54120 1 0 0 0 0 54121 1 0 0 0 0 54122 1 0 0 0 0 55123 1 0 0 0 0 55124 1 0 0 0 0 55125 1 0 0 0 0 57 58 1 0 0 0 0 58126 1 0 0 0 0 58127 1 0 0 0 0 59128 1 0 0 0 0 M END > 503 $$$$ 504 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.5090 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -0.2280 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.3540 -1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 1.1200 2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 0.9130 3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 0.2820 2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 1.2340 4.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.3050 -0.8190 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6620 2.3780 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 3.6420 2.2500 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6270 2.5040 2.4930 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2700 1.2440 2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 1.7320 3.1650 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6250 3.2350 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 4.4060 -0.0070 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6690 3.8560 0.7890 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7400 4.8280 0.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 5.5060 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 5.4290 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 4.0370 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 2.5840 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 3.7220 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 6.1160 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 6.0960 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 2.6340 3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 4.5640 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.4900 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.8480 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.8600 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -0.8010 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 0.6530 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 0.5380 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 3.1160 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 1.3620 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 0.8970 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 0.4540 3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 1.4810 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 4.8720 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 2.9110 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 3.6350 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 5.0990 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 2.8430 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.4950 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 3.0670 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 6.8200 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 5.9700 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 22 2 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 25 2 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M END > 504 $$$$ 505 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -0.3640 1.2880 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 0.0070 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.8310 0.3330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1230 1.3080 0.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8880 2.0640 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.1300 -1.1340 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2100 0.1100 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 1.6600 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 0.8240 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 2.7730 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -0.1710 0.9630 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9820 -0.6410 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -0.6390 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -1.8410 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -1.9810 -1.6580 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9930 -1.4310 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.2840 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -4.0780 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -5.3620 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -6.5080 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -6.5470 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -2.3020 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -7.7890 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.3620 2.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -0.4690 3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -0.6680 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.4060 2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 1.8060 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.7770 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 1.6690 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 3.0060 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 2.2790 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.7020 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.1660 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 0.8010 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 0.0820 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 1.4670 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 3.4020 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 3.0610 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -0.0460 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -3.8750 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -3.0550 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -3.4870 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -4.3070 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -5.3360 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -6.5490 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -7.4490 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -5.6700 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -1.3880 -3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -2.7230 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -3.0220 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -7.5630 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -8.2880 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -8.4410 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -0.7000 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.6070 4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 0.1570 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 M END > 505 $$$$ 506 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3850 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -0.7100 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 2.0350 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 1.2960 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -0.0660 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -0.9510 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -0.3810 -1.2890 N 0 0 3 0 0 0 0 0 0 0 0 0 3.5390 2.3040 0.0620 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1150 2.2290 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 3.1940 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 4.5480 2.0310 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3720 4.8040 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 3.6290 -0.2100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4520 3.3620 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 2.0810 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 4.6470 2.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 2.0730 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 0.7560 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 -1.4140 -1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 5.1080 3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 5.2380 4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 5.4180 4.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.5440 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.7890 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -1.1170 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -1.9110 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 1.2910 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 3.0120 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 5.3040 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 5.6490 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 5.0710 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 3.8440 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 2.2780 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 2.1000 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 2.8750 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 0.6170 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 0.7950 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 -2.2090 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -0.9730 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -1.8270 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 4.9140 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 4.6160 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 6.2790 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 6 2 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END > 506 $$$$ 507 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3380 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 3.3350 3.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 6.3190 -0.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 3.6230 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 5.6760 0.2560 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9750 5.4720 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 4.6650 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 3.6870 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 4.3220 0.4710 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1540 3.3830 -0.7170 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1880 4.4560 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 3.4030 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 2.8880 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 1.8880 -2.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 3.1020 -3.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 2.3590 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8010 4.2930 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 9.6340 -2.6100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8660 8.1890 -2.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4540 7.6470 -1.1040 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0540 8.4860 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 9.8370 -0.1280 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9200 10.4680 -1.3940 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3110 7.3860 -3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 10.1730 -3.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 10.6300 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 10.1130 2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 11.8000 -1.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.0780 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.3980 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -1.4070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 3.6970 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 6.2970 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 4.8130 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.3990 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 1.6540 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 1.3940 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 4.7050 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 5.0960 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 9.6530 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 8.1640 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 7.6340 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 9.8530 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 10.4880 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 6.4570 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 9.6880 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 11.6790 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 10.5400 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 10.5690 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 12.2590 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 5 21 1 0 0 0 0 5 36 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 7 12 1 0 0 0 0 7 19 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 29 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 47 1 0 0 0 0 27 32 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END > 507 $$$$ 508 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 93 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.5120 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0100 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.5170 -1.2120 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4320 2.0210 0.0060 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2340 -0.0940 -1.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3050 1.4270 -1.1030 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6410 -0.3920 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 1.4860 -3.3560 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9970 1.7260 1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 1.8780 -0.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7060 1.3120 -1.9630 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9160 2.2440 -1.8070 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2550 3.6110 -1.7660 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9140 3.3980 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -1.9670 -1.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 0.0610 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 1.8550 -2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4190 1.4790 -2.6410 N 0 0 3 0 0 0 0 0 0 0 0 0 -0.1760 2.0340 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 1.8220 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 0.9640 -3.3740 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9120 0.6980 -4.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -0.6180 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -0.0350 -1.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 2.7630 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 2.0880 -2.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 3.9710 -3.2050 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0610 2.9180 -3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1930 2.3460 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 4.2060 -3.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 5.1480 -5.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -2.5070 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -1.7870 -1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -3.9710 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -4.8000 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -6.1690 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -6.7280 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -5.9220 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -4.5420 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -3.7270 -1.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -4.0840 -1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -5.0620 -2.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 -3.2670 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 1.4860 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 4.3700 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8940 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8630 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.3740 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3860 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 3.1070 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -0.9040 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -1.0420 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 2.0320 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 3.8150 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 3.8680 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -0.5030 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.0380 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 2.9210 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 3.1010 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.5310 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 0.7560 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 2.3250 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 2.2350 -4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 0.8960 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 0.7570 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -0.3830 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 2.9400 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 2.4630 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 3.6780 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 4.9340 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 2.8880 -4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 3.2640 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 2.2060 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2880 3.3710 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 1.6570 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 4.7860 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 6.1080 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8990 5.2700 -5.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -4.3690 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -6.8080 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -7.8020 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -6.3660 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -2.9020 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -2.4340 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -2.8820 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -3.8940 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 1.7460 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 48 1 0 0 0 0 2 49 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 6 10 1 0 0 0 0 6 17 1 0 0 0 0 7 21 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 28 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 45 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 32 1 0 0 0 0 16 18 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 64 1 0 0 0 0 22 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 30 31 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 79 1 0 0 0 0 36 37 1 0 0 0 0 36 80 1 0 0 0 0 37 38 2 0 0 0 0 37 81 1 0 0 0 0 38 39 1 0 0 0 0 38 82 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 83 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 84 1 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 44 87 1 0 0 0 0 M END > 508 $$$$ 509 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.0310 1.2570 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.0800 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -0.9320 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.5990 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 3.1260 -1.9800 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6190 5.4590 5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 4.0480 5.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 7.5870 4.7840 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6920 8.1790 4.0550 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7790 7.5690 2.6530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8620 6.0450 2.7720 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2780 5.5620 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 6.0620 4.8210 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5670 8.0950 6.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 9.5960 3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 8.0600 1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 5.4650 1.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 4.2870 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 4.0480 1.4630 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3950 3.7350 1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 4.0770 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 3.5220 0.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 4.1680 -0.8480 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0920 1.7620 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7340 5.1320 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 3.7310 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 1.6160 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 4.6400 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 4.8610 -2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 4.7460 -0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 3.2840 -2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -0.6720 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -1.9840 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.7570 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 3.2210 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 5.6570 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 5.9080 6.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 3.5990 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 7.8600 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 7.9480 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 7.8420 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 5.7710 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 5.7890 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 9.0580 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 10.0380 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 7.7130 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 3.5770 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 4.1880 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 1.0610 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 1.3680 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 2.0790 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.9540 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 0.5320 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 5.0970 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 2.6580 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 32 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 18 21 2 0 0 0 0 18 23 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 27 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 55 1 0 0 0 0 32 56 1 0 0 0 0 M END > 509 $$$$ 510 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0750 1.3860 -0.0160 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1840 -5.6770 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -4.7510 -2.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -6.6550 -2.0450 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9270 -6.5120 -1.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3470 -5.0960 -1.0810 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4730 -4.0790 -0.8740 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4880 -4.2880 -1.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -5.5780 -1.8010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6360 -7.9480 -1.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -7.4660 -1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -4.9270 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.7560 -1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.6990 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 1.2640 -1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.7260 -0.7160 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2770 -1.7920 0.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -1.4530 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -0.3630 -1.0040 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0330 -0.1570 -0.1080 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3890 1.8700 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 0.7600 -0.6010 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8650 -0.5920 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -0.2860 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 0.2340 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.3930 2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 0.3670 2.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.8160 3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 0.6350 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.9200 -1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 3.0490 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 3.5750 0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 3.6620 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.6770 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -5.4430 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -6.6900 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 -4.7590 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -6.5340 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -6.6820 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -4.9430 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -4.2060 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -5.7250 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -8.6800 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -7.4310 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -4.0520 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 1.9910 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -1.8590 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -1.8040 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 2.7960 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 2.0240 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -0.0100 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -0.6610 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 0.9980 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 1.2550 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -0.3040 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 1.1610 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 3.2540 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 4.7430 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 3.4310 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 30 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 13 16 1 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 14 26 1 0 0 0 0 15 22 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 24 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 25 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END > 510 $$$$ 511 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.0310 1.2570 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.0800 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -0.9320 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.5990 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 3.1260 -1.9800 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6190 5.4590 5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 4.0480 5.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 7.5870 4.7840 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6920 8.1790 4.0550 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7790 7.5690 2.6530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8620 6.0450 2.7720 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2780 5.5620 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 6.0620 4.8210 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5670 8.0950 6.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 9.5960 3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 8.0600 1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 5.4650 1.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 4.2870 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 4.0480 1.4630 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3950 3.7350 1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 4.0770 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 3.5220 0.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 4.1680 -0.8480 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0920 1.7620 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.0150 0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7340 5.1320 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 3.7310 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 1.6160 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 4.6400 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 4.8610 -2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 4.7460 -0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 5.2140 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 3.2840 -2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -0.6720 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -1.9840 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.7570 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 3.2210 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 5.6570 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 5.9080 6.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 3.5990 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 7.8600 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 7.9480 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 7.8420 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 5.7710 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 5.7890 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 9.0580 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 10.0380 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 7.7130 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 3.5770 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 4.1880 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 1.0610 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 1.3680 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 2.0790 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.9540 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 0.5320 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 6.1360 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 4.4140 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 5.3630 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 2.6580 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 33 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 17 19 1 0 0 0 0 18 21 2 0 0 0 0 18 23 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 27 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 28 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 32 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 M END > 511 $$$$ 512 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 105111 0 0 1 0 0 0 0 0999 V2000 -2.2030 1.8350 -1.8650 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1440 0.4080 -1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -0.1260 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 0.3720 -3.6190 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4370 1.9040 -3.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8350 2.4120 -2.2380 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5560 2.2590 -0.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 3.8390 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 2.3780 -3.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -0.1020 -2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 0.5100 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 1.8660 -0.1400 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4730 2.9660 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 0.4540 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 1.5850 2.7960 C 0 0 1 0 0 0 0 0 0 0 0 0 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0 0 0 0 42 97 1 0 0 0 0 42 98 1 0 0 0 0 42 99 1 0 0 0 0 43100 1 0 0 0 0 43101 1 0 0 0 0 43102 1 0 0 0 0 46103 1 0 0 0 0 46104 1 0 0 0 0 46105 1 0 0 0 0 M END > 513 $$$$ 514 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0080 1.3990 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.0020 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -0.6740 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 0.0240 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.1130 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 1.4190 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 2.1810 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 3.6540 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 4.3140 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 3.5860 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 4.1980 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 1.5960 -0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 2.0580 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -0.6510 -0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 4.4280 -0.0580 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7690 4.0360 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5950 4.9650 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4740 4.6310 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 6.0690 -1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 4.1300 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 4.9960 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1110 4.4480 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2200 2.9700 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3550 5.2970 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.5500 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -1.7540 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 5.3930 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 2.2240 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -0.8210 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 5.4950 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 4.3430 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0710 5.5030 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 3.8050 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 4.3410 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 3.0800 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 6.0680 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 2.4280 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1450 2.7650 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 2.6450 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 6.3320 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 5.2400 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 4.9330 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END > 514 $$$$ 515 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 76 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.6590 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6220 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -2.1100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -4.2000 -0.1700 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9040 -4.7630 -0.1250 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5770 -4.3190 1.1770 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5540 -2.7900 1.2590 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2030 -2.3300 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.6760 -0.0370 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8680 -4.5470 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -6.1900 -0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -4.7780 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 -2.3700 2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 2.7380 8.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 3.2310 8.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1600 3.9410 8.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 4.5690 8.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2850 4.4670 10.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3270 3.7760 10.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 3.1440 10.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7750 3.8310 6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 3.1030 6.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5470 4.3740 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4680 4.3950 5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 3.1780 4.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 2.7660 5.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6410 1.2590 5.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 2.4750 3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 1.3320 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 0.9010 4.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7680 -0.6170 4.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2600 -0.9530 2.6270 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1870 -0.4650 1.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9160 0.6310 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 2.8380 2.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 -1.3100 4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2070 -2.1470 5.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 3.2920 5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -2.4580 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -2.4490 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -4.6150 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -4.3860 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -4.7370 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -2.3740 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -2.2580 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -5.5000 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -6.6150 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 -4.5320 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 2.2070 8.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9850 5.1090 8.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 4.9400 10.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4190 3.7290 11.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5160 2.6080 10.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 5.2540 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 4.4150 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7670 5.4230 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 3.8000 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 0.7200 5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 0.9860 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 1.4150 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -0.9410 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -0.4880 2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 0.9720 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -1.1160 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1500 -2.6440 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -2.3410 5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 5 11 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 14 53 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 22 58 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 40 1 0 0 0 0 29 32 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 37 2 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 34 1 0 0 0 0 33 38 1 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 67 1 0 0 0 0 35 36 1 0 0 0 0 36 68 1 0 0 0 0 38 39 2 0 0 0 0 38 69 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 M END > 515 $$$$ 516 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 109114 0 0 1 0 0 0 0 0999 V2000 -0.5700 0.4010 0.2160 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3110 -1.1030 0.1920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5760 -1.5290 1.3680 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7590 1.1500 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 0.8210 1.3690 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8320 -0.6860 1.4310 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7190 -1.0240 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -0.4540 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 1.4940 1.1770 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0590 1.0590 2.1590 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1950 3.6510 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 3.0170 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 3.0380 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 1.5900 1.6740 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5030 1.3170 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 2.0890 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 3.9030 1.1860 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5120 3.5850 2.3470 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8100 4.3840 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 4.2530 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4710 4.7530 -0.1800 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2480 3.8180 -0.1690 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5570 -1.8020 0.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.7570 -0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -1.5290 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 1.3640 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 1.6900 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 0.7960 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 4.2780 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 2.5080 -0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1300 4.7020 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 4.0120 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 3.8350 4.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 4.5110 3.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.9730 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -3.2600 0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -3.9230 0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 0.7250 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 1.0810 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 0.4110 0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 5.9000 8.3760 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7990 4.3850 8.4930 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5280 3.8740 7.2470 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7300 4.2660 6.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5660 5.6860 5.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8490 6.2150 7.0870 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6430 2.4510 7.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 4.0860 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1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 5.4360 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 4.0190 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3640 4.8550 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 3.2120 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1540 5.7660 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -1.6050 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -2.2000 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -1.8670 3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -0.5190 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.0800 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 0.9490 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 2.4510 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 1.3820 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 2.7770 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 1.3610 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 1.0960 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 1.0000 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -0.2700 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 5.3100 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 4.2110 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 3.6400 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1500 2.4380 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 3.6750 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 5.0590 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0170 5.3360 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.8230 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 0.1830 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 1.5130 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 1.8050 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 6.3870 8.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 3.9020 8.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5220 4.3190 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 3.7880 6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 5.7620 7.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 2.0580 6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7310 3.1420 9.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 8.1460 7.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 8.1740 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 6.2080 10.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 8.9670 5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 56 1 0 0 0 0 3 6 1 0 0 0 0 3 25 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 57 1 0 0 0 0 4 58 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 59 1 0 0 0 0 7 60 1 0 0 0 0 8 10 1 0 0 0 0 8 61 1 0 0 0 0 8 62 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 54 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 63 1 0 0 0 0 12 64 1 0 0 0 0 12 65 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 66 1 0 0 0 0 15 67 1 0 0 0 0 16 18 1 0 0 0 0 16 68 1 0 0 0 0 16 69 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 70 1 0 0 0 0 19 71 1 0 0 0 0 20 21 1 0 0 0 0 20 72 1 0 0 0 0 20 73 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 74 1 0 0 0 0 22 29 1 0 0 0 0 22 30 1 0 0 0 0 23 75 1 0 0 0 0 24 38 1 0 0 0 0 25 76 1 0 0 0 0 25 77 1 0 0 0 0 25 78 1 0 0 0 0 26 79 1 0 0 0 0 26 80 1 0 0 0 0 26 81 1 0 0 0 0 27 82 1 0 0 0 0 27 83 1 0 0 0 0 27 84 1 0 0 0 0 28 85 1 0 0 0 0 28 86 1 0 0 0 0 28 87 1 0 0 0 0 29 88 1 0 0 0 0 29 89 1 0 0 0 0 29 90 1 0 0 0 0 30 91 1 0 0 0 0 31 92 1 0 0 0 0 31 93 1 0 0 0 0 31 94 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 44 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 95 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 39 96 1 0 0 0 0 39 97 1 0 0 0 0 39 98 1 0 0 0 0 41 42 1 0 0 0 0 41 46 1 0 0 0 0 41 50 1 0 0 0 0 41 99 1 0 0 0 0 42 43 1 0 0 0 0 42 48 1 0 0 0 0 42100 1 0 0 0 0 43 44 1 0 0 0 0 43 47 1 0 0 0 0 43101 1 0 0 0 0 44 45 1 0 0 0 0 44102 1 0 0 0 0 45 46 1 0 0 0 0 46 49 1 0 0 0 0 46103 1 0 0 0 0 47104 1 0 0 0 0 48105 1 0 0 0 0 49 51 1 0 0 0 0 49106 1 0 0 0 0 49107 1 0 0 0 0 50108 1 0 0 0 0 51109 1 0 0 0 0 M END > 516 $$$$ 517 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 147154 0 0 1 0 0 0 0 0999 V2000 1.0240 -3.7530 -0.5260 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1760 -4.3640 0.2050 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0670 -4.0500 1.6990 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1710 -4.5580 2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.9880 1.5890 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3160 -4.2990 0.0900 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1800 -5.7800 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -4.1030 -1.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -4.5820 2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -3.6810 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -2.6350 1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.9110 3.4990 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2100 -0.4910 4.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.2680 5.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -1.5720 4.9950 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7790 -2.0690 3.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2870 -2.2410 3.2570 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8330 -1.0790 3.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -3.3240 3.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -2.5560 5.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 2.8000 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 1.5320 1.5860 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1060 0.2510 1.7070 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5490 0.1490 3.1310 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7100 0.1860 4.1280 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4590 1.3880 3.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 1.5160 2.6440 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5220 1.6020 0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 0.2910 0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 0.1480 5.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 1.0970 7.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -0.1840 6.4540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5030 -1.0090 7.5550 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8040 0.7640 8.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 0.0750 9.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4010 -1.1820 8.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7170 -1.8980 9.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -2.4290 10.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 -0.3380 10.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6810 -1.2850 11.3760 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8110 0.4510 11.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 0.8880 10.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 -0.7410 12.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 -1.8460 12.1090 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4880 -2.6840 13.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6840 -3.0190 14.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9350 -0.9690 13.5310 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3470 -1.7410 14.7080 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4220 -2.0640 15.7410 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6270 -2.7560 15.1270 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2000 -1.9880 13.9410 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1050 -1.7180 12.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8480 -0.6800 14.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2820 -2.8580 13.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3160 -3.1390 14.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6470 -2.9100 16.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2950 -0.8590 15.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 0.0150 13.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6520 -2.7730 11.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -0.5140 12.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 1.0740 9.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.4080 7.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -2.4090 6.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 3.5740 3.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 3.0850 1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -1.2430 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6.5090 -0.6050 14.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 -2.1870 10.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 -3.2690 11.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -3.5230 10.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -1.1960 13.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 0.2830 12.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -0.0830 11.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.5240 9.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 0.5590 10.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 1.8530 10.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 0.5870 8.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -0.3350 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -2.8570 6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -3.0440 7.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -2.3090 6.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 3.9200 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.9630 9.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5460 1.1100 17.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0120 0.3150 19.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6850 0.1070 18.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 71 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 72 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 73 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 74 1 0 0 0 0 6 10 1 0 0 0 0 6 75 1 0 0 0 0 7 76 1 0 0 0 0 8 77 1 0 0 0 0 9 78 1 0 0 0 0 9 79 1 0 0 0 0 9 80 1 0 0 0 0 10 81 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 82 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 83 1 0 0 0 0 14 84 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 85 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 86 1 0 0 0 0 17 87 1 0 0 0 0 18 24 1 0 0 0 0 19 88 1 0 0 0 0 20 89 1 0 0 0 0 21 27 1 0 0 0 0 21 64 2 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 22 90 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 23 91 1 0 0 0 0 24 25 1 0 0 0 0 24 92 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 93 1 0 0 0 0 26 27 1 0 0 0 0 27 94 1 0 0 0 0 28 95 1 0 0 0 0 29 96 1 0 0 0 0 30 32 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 97 1 0 0 0 0 31 98 1 0 0 0 0 32 33 1 0 0 0 0 32 99 1 0 0 0 0 33 36 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34100 1 0 0 0 0 34101 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 36102 1 0 0 0 0 37 38 1 0 0 0 0 37103 1 0 0 0 0 37104 1 0 0 0 0 38 40 1 0 0 0 0 38105 1 0 0 0 0 38106 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 39107 1 0 0 0 0 40 44 1 0 0 0 0 40 60 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 41108 1 0 0 0 0 42109 1 0 0 0 0 42110 1 0 0 0 0 43 44 1 0 0 0 0 43 47 1 0 0 0 0 44 45 1 0 0 0 0 44 59 1 0 0 0 0 45 46 1 0 0 0 0 45111 1 0 0 0 0 45112 1 0 0 0 0 46 48 1 0 0 0 0 46113 1 0 0 0 0 46114 1 0 0 0 0 47 48 1 0 0 0 0 47 52 1 0 0 0 0 47 58 1 0 0 0 0 48 49 1 0 0 0 0 48 57 1 0 0 0 0 49 50 1 0 0 0 0 49 67 1 0 0 0 0 49115 1 0 0 0 0 50 51 1 0 0 0 0 50 56 1 0 0 0 0 50116 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 52117 1 0 0 0 0 52118 1 0 0 0 0 53119 1 0 0 0 0 53120 1 0 0 0 0 53121 1 0 0 0 0 54 55 1 0 0 0 0 54122 1 0 0 0 0 54123 1 0 0 0 0 55124 1 0 0 0 0 56125 1 0 0 0 0 57126 1 0 0 0 0 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0.6190 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6380 5.7440 2.0640 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2340 5.6790 0.5770 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0450 4.1980 0.1670 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4890 6.2350 -0.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6680 7.6570 0.1270 N 0 0 3 0 0 0 0 0 0 0 0 0 1.6910 8.1060 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 8.5220 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 7.4960 3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 8.8630 4.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 4.6700 2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 4.9540 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 6.4510 0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 3.9990 0.3180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1980 3.3820 0.7300 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7220 2.4470 -1.4120 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6690 3.6590 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 3.0120 -2.1110 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0860 4.1930 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 9.9740 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 3.7160 0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 2.0070 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8.4300 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 7.3050 4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 6.8480 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 9.1140 5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 5.8090 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 5.1840 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 4.0860 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 6.1470 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 4.4990 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 3.3760 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 3.3680 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 4.2310 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 5.1160 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 10.2710 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 10.0660 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 10.6200 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 2.7860 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 3.1730 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 2.2320 -4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 1.4140 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 6.2440 -1.5350 H 0 0 0 0 0 0 0 0 0 0 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0 0 38 39 1 0 0 0 0 38100 1 0 0 0 0 38101 1 0 0 0 0 39 40 1 0 0 0 0 39102 1 0 0 0 0 40 41 1 0 0 0 0 40 45 1 0 0 0 0 40 49 1 0 0 0 0 41 42 1 0 0 0 0 41103 1 0 0 0 0 41104 1 0 0 0 0 42 43 1 0 0 0 0 42 53 1 0 0 0 0 42105 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 43106 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 46107 1 0 0 0 0 46108 1 0 0 0 0 46109 1 0 0 0 0 47110 1 0 0 0 0 47111 1 0 0 0 0 47112 1 0 0 0 0 48113 1 0 0 0 0 49114 1 0 0 0 0 49115 1 0 0 0 0 49116 1 0 0 0 0 50117 1 0 0 0 0 50118 1 0 0 0 0 50119 1 0 0 0 0 51120 1 0 0 0 0 51121 1 0 0 0 0 51122 1 0 0 0 0 52123 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 2 0 0 0 0 55124 1 0 0 0 0 55125 1 0 0 0 0 55126 1 0 0 0 0 M END > 521 $$$$ 522 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 147154 0 0 1 0 0 0 0 0999 V2000 -2.1920 -0.6130 2.1080 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0880 -2.1410 2.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8480 -0.0260 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.4660 2.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 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48129 1 0 0 0 0 49 50 1 0 0 0 0 50 51 2 0 0 0 0 50 52 1 0 0 0 0 52130 1 0 0 0 0 52131 1 0 0 0 0 52132 1 0 0 0 0 M END > 523 $$$$ 524 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5020 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.4560 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 0.5990 -0.5100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4890 1.8960 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 0.4420 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -0.0260 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -0.0160 1.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 0.4550 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 0.7520 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 0.5880 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.7470 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 2.3020 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 2.4360 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 2.9790 -2.4280 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1870 1.4330 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 2.1100 -1.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1730 2.2080 -1.1910 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6010 2.9090 0.0970 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1350 2.0670 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 2.0250 1.3140 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9520 4.2080 0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 0.8270 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 1.1360 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 4.4310 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 3.3730 -2.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 0.9840 -1.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -0.1380 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 -0.0540 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -1.2150 -1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 5.1740 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 6.5450 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 4.9440 1.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 2.7160 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 2.1600 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -0.3540 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 0.5760 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 1.1510 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 1.8390 -4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 3.2900 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 3.1320 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 1.4670 -3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 0.4410 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 1.3570 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 3.1580 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 3.0270 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 2.5530 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 1.0670 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 3.0380 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 0.3200 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 0.2360 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 0.1290 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 1.0980 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.5480 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 4.9860 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 5.0500 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 0.9910 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 -0.5040 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -0.5880 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 6.5620 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 7.2820 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 6.7830 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 17 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 24 1 0 0 0 0 21 49 1 0 0 0 0 22 31 1 0 0 0 0 23 27 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 M END > 524 $$$$ 525 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3410 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.4110 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 0.6600 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 1.7690 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 2.4050 1.2140 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5010 1.9590 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 1.6000 -0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 2.2220 0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7930 2.3580 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 6.2380 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 6.3920 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 5.3160 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 4.8820 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 3.8170 1.5090 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3390 3.8730 1.4040 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9140 3.0380 2.5460 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4960 1.5850 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 1.4410 2.2090 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5480 4.0760 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 1.9260 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 0.0060 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9990 3.4140 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2080 5.1600 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 4.2690 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 5.6970 1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 3.4760 3.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 3.3340 4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 3.7660 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 2.8590 4.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -0.6480 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 0.6350 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 2.7900 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 3.2040 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 3.2800 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 1.4910 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 7.0490 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 6.2560 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 7.3710 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 4.8370 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 4.7370 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 3.1210 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 0.9390 3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 1.2780 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 1.6330 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -0.2090 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -0.1090 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -0.6860 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 3.5740 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 2.3640 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 4.8090 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 3.1440 7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 3.6570 6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 15 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 16 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 22 1 0 0 0 0 19 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END > 525 $$$$ 526 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 87 92 0 0 1 0 0 0 0 0999 V2000 -0.0280 1.4740 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -0.0600 1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -0.4070 -1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 0.3670 -3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.2960 -1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.0530 -0.1790 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4740 -0.4640 -0.0450 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3280 0.1280 -1.1700 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7020 -0.2400 -2.5190 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2580 0.2680 -2.5570 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3940 -0.1480 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -0.9010 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -1.9400 2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -0.5490 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 0.4800 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 2.4040 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 2.0490 -0.0280 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2790 3.3170 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 3.0120 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 4.2810 -0.6020 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6770 3.9360 0.8290 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6870 2.9250 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 3.5320 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 4.9160 -0.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4160 4.4150 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 5.4020 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 4.6920 -1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 5.2740 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8990 6.2940 1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7860 5.5350 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 4.8360 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 4.8400 -0.9300 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8270 4.9680 0.4810 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6680 3.9500 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 2.7530 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 3.3160 -1.0980 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8250 3.0230 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0210 2.6550 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9360 2.4680 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2950 2.7220 -3.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 3.0840 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1000 2.1320 -2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 0.1760 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.3980 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -1.5510 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 1.2120 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -1.3230 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 1.3550 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -1.2350 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 0.2820 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.2130 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.9330 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -0.9930 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.5350 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 0.0010 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 1.3970 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 0.7190 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 1.5020 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 3.1250 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.3330 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 4.0320 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 3.0650 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 2.2920 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 3.2600 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 2.6720 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 2.0230 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 3.2220 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 5.9910 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 5.2960 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 6.4600 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 3.6250 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 5.1030 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 4.8290 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 6.1830 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 5.5180 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 6.3770 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6720 6.5860 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4770 5.0570 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 5.4560 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 4.3560 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 3.6610 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7540 2.2820 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 2.0310 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 2.8870 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2780 2.5170 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 2.3780 -3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7110 4.0960 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 17 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 4 9 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 17 60 1 0 0 0 0 18 21 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 19 64 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 25 2 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 68 1 0 0 0 0 25 33 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 29 33 1 0 0 0 0 29 76 1 0 0 0 0 30 32 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 36 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 37 1 0 0 0 0 36 84 1 0 0 0 0 37 38 2 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 85 1 0 0 0 0 39 40 1 0 0 0 0 39 42 2 0 0 0 0 40 41 1 0 0 0 0 41 86 1 0 0 0 0 41 87 1 0 0 0 0 M END > 526 $$$$ 527 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 93 0 0 1 0 0 0 0 0999 V2000 1.2460 3.6030 4.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4010 2.6260 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 2.7920 5.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 4.2490 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 3.5230 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 4.1150 0.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 2.4080 -0.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 4.1190 2.6590 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1700 4.3270 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 3.2270 3.4490 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1010 3.2060 2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 3.3570 1.5580 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.3250 9.5800 7.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 10.7030 7.6420 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6760 11.3810 6.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 8.5560 6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 9.2280 5.1050 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0500 10.3840 5.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4160 11.0390 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 10.0290 3.6320 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0600 8.2110 4.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2560 8.7730 3.2290 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9930 5.9840 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 6.9110 4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 6.2360 3.2240 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2620 7.6900 2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 7.8100 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 6.4510 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 5.4650 2.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4600 10.1840 8.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 12.3670 5.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 12.2140 7.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1070 9.6760 4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 9.0680 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 9.6850 4.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 5.8950 4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 2.2630 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 1.3400 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 3.2110 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 4.6680 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 5.2330 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 4.3620 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 3.6770 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 3.5230 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 5.3190 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 4.1670 4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 2.3760 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 9.0750 8.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 9.9770 6.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0230 11.4580 8.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7080 8.1660 6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 7.7380 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 9.9120 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 11.3780 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 11.9000 4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 10.4940 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 7.9500 5.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 4.9500 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 6.1400 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 6.3770 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7310 7.1140 3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 8.7410 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 6.3720 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 6.2690 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 5.3540 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 9.7850 9.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 13.1280 6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 12.8410 4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4750 11.8330 5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 11.5530 7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 12.7230 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 12.9520 7.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 10.2360 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 10.3110 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 8.8010 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 9.2270 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 8.2240 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 9.9640 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 10.4370 4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 4.8300 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 6.1460 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 6.4680 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 1.5910 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 0.7480 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 0.7650 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 3.7830 4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 2.4020 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 3.8650 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 29 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 50 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 57 1 0 0 0 0 22 26 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 25 36 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 35 79 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 38 85 1 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 39 88 1 0 0 0 0 M END > 527 $$$$ 528 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.3980 1.6080 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.5470 0.5210 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8190 2.0310 0.7830 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8760 2.4370 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 0.5820 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.9450 2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.9250 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.1150 3.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -0.1440 0.9110 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1920 0.1240 -0.1150 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3890 -2.3140 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.6260 1.1560 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1400 -2.1650 -1.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1020 -0.6980 -1.3900 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4690 -0.6150 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -1.4470 -3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -2.8970 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -3.1280 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -3.1560 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -4.5560 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -2.4730 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.1340 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -1.8800 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -0.2190 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -0.9490 -4.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 0.1730 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 0.1700 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -0.2060 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 0.4680 -0.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 1.9940 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 1.7540 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 0.3910 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 2.6840 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 2.3370 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 3.4950 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 3.8910 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 2.7540 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -1.8270 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -3.3610 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0340 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -1.0300 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 0.4150 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -3.4790 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -3.2680 -4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -3.3630 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -3.9360 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -2.1900 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -4.5960 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -5.2760 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -4.7980 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -0.2800 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.6490 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 0.9320 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.8190 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -0.4420 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 -1.0770 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 0.6280 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 26 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 23 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END > 528 $$$$ 529 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 89 0 0 1 0 0 0 0 0999 V2000 3.6910 3.9840 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 3.2350 0.6160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0750 2.0900 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 3.0220 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 1.9570 2.3530 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2670 1.2160 1.8760 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9380 0.0630 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -0.9520 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 0.9470 2.4160 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3810 -0.2810 3.2690 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1040 0.5670 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 1.5600 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 2.6350 2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 1.2340 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 4.1570 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 4.7940 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 5.7640 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 4.5880 -1.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 2.6720 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 -0.3840 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 0.7320 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 -0.7490 3.1640 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5520 -1.2420 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -2.5010 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -3.4950 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0350 -1.7640 2.7550 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6480 -3.1940 3.0780 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6310 -4.2050 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6010 -4.0400 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2200 -2.6880 0.6430 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5330 -1.5230 1.3450 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0340 -4.5230 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 -3.4460 4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6230 -0.4200 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -2.4550 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -0.0010 4.7600 C 0 0 0 0 0 0 0 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0 0.3880 6.7630 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 5.7720 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 5.4590 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 3.5000 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 1.9730 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 3.0560 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 0.4590 4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 -1.2400 5.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3360 -0.1120 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -2.8060 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6320 -3.9970 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 -5.2120 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 -4.8350 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -4.0910 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2770 -2.7030 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -1.1650 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 -4.5120 4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 -3.1130 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 -2.8940 5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3720 -0.6750 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0980 -0.3450 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 0.5350 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1510 -2.4730 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6280 -1.4860 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 -3.2410 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -0.9370 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 0.6720 5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 0.4620 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 41 1 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 37 1 0 0 0 0 10 23 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 17 60 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 19 63 1 0 0 0 0 20 22 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 20 66 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 25 27 1 0 0 0 0 25 32 2 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 30 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 30 72 1 0 0 0 0 31 34 1 0 0 0 0 31 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 M END > 529 $$$$ 530 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 86 90 0 0 1 0 0 0 0 0999 V2000 0.6560 2.1250 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.6360 0.0700 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9540 -0.1540 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 2.3440 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 1.6580 1.4680 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4210 0.1740 1.4160 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0520 -0.5340 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -0.4920 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 1.8060 1.3830 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0730 0.9490 2.3660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1950 3.3800 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 3.2710 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 2.3830 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 0.9880 1.9840 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4180 0.3250 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9090 0.5770 2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4970 2.7150 1.6050 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2000 2.0730 2.8020 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7060 2.3290 2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2830 1.8310 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6010 2.5700 0.2650 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1020 2.2410 0.2910 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2040 2.3550 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 1.5340 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 3.8090 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 2.7100 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4280 2.9510 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 0.4350 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 0.1610 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1980 2.1100 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.0460 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -1.6500 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 2.3080 5.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 3.5820 4.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 0.4520 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 0.2510 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 0.6280 -2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -0.2280 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 1.5010 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 2.6390 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 2.5410 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 0.2570 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 1.9160 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 3.4100 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -0.0660 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.5820 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -1.0230 3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -1.0250 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 4.3440 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 3.8490 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 3.7020 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 0.6160 4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 -0.7670 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4790 0.1130 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 0.1250 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8900 3.4020 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1910 1.8120 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3560 2.0290 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1120 0.7600 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7390 3.6420 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 1.1640 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 2.4360 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.7760 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 3.3520 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 0.9680 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 2.5770 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 1.4720 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5740 4.0270 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 2.6030 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 2.7270 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 0.6460 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 0.0910 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 -0.8390 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0440 1.0370 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7100 2.6380 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 2.3270 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.4170 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -0.4160 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 1.1120 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -1.8260 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.2650 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -1.9090 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 2.7440 6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 0.1090 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 1.1280 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -0.6290 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 42 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 60 1 0 0 0 0 22 27 1 0 0 0 0 22 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 26 33 1 0 0 0 0 26 34 2 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 27 70 1 0 0 0 0 28 35 1 0 0 0 0 29 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 83 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 M END > 530 $$$$ 531 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 78 83 0 0 1 0 0 0 0 0999 V2000 0.8710 1.0780 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 1.0050 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 0.0430 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 1.7090 -1.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 1.9560 -0.0600 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0660 1.4290 -1.0340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0550 2.4330 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 3.7740 -1.8800 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3540 4.7040 -2.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 0.7270 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 1.6610 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 3.4080 -0.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7760 4.3020 -0.5790 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2730 5.7420 -0.8180 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9700 3.8730 1.1410 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4320 5.2900 0.9560 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7890 5.7120 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 5.9830 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 5.8120 -0.3580 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0840 5.3610 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 6.2190 -2.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 4.7990 -0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 2.9800 1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 6.5990 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 6.2600 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 6.3140 1.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 7.5000 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 7.6540 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 5.7750 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 6.4200 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 5.2200 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 4.2250 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 6.3950 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 2.3850 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 1.4480 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 0.8300 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.0440 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -0.3080 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 0.3020 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 1.1820 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 2.6190 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 4.3000 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 0.2840 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 0.1250 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -0.9750 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 0.7720 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 2.5800 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 2.0400 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 3.6430 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 4.4320 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 2.5020 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 1.1920 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 3.4800 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 3.8660 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 6.7600 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 4.3800 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 6.0940 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 5.7320 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 7.6100 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 8.3450 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 7.9980 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 4.7840 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 6.4680 4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 5.7280 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 5.5430 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 6.9940 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 7.0410 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 4.1060 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 4.5860 -3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 3.2650 -2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.0350 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -0.5230 5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -0.9930 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 0.0910 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 1.6570 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 5.1880 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 4.3020 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 3.4080 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 17 1 0 0 0 0 14 21 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 58 1 0 0 0 0 22 31 1 0 0 0 0 23 34 1 0 0 0 0 24 26 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 34 35 1 0 0 0 0 34 41 2 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 71 1 0 0 0 0 37 38 1 0 0 0 0 37 72 1 0 0 0 0 38 39 2 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 39 74 1 0 0 0 0 40 75 1 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 42 78 1 0 0 0 0 M END > 531 $$$$ 532 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 48 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.4330 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1520 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 3.5830 -0.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 4.3490 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 3.6490 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.4720 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0740 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 1.5250 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.2000 0.0360 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7990 0.0610 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -0.6390 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -1.9970 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -2.6420 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -1.9390 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -0.5860 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.6400 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.0510 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.8570 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.1070 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -1.9790 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 4.1300 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 3.5160 -1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 5.5020 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 2.2020 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 -2.5760 -0.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3090 -3.9680 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.9650 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 4.4460 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 5.3420 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 3.9870 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 3.9360 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 1.6330 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 1.9990 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -2.5430 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -3.6950 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -0.0430 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.2370 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.9390 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 5.8520 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 6.1910 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 5.4570 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -4.1040 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -4.5070 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -4.3530 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 2 0 0 0 0 1 27 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 11 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END > 532 $$$$ 533 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 103108 0 0 1 0 0 0 0 0999 V2000 0.4840 1.8400 0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 0.5080 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -0.1020 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -0.2010 0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 2.4430 -1.4300 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3120 3.0080 -1.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 4.3340 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 4.3260 0.3290 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9510 3.7580 0.6910 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8120 2.3580 0.0840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 0.8470 -12.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -1.5970 -13.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -0.2790 -14.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 0.9060 -13.7940 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7080 -1.6610 -12.3580 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4070 -0.4620 -11.7170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1290 -1.9140 -10.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -1.6820 -11.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -0.8340 -9.6360 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2070 -0.5310 -10.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -0.2960 -9.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -0.3530 -7.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -1.2040 -8.1470 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8610 -0.2080 -7.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6450 -1.4450 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.2560 -7.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -0.2440 -5.4420 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8490 -0.2880 -5.9150 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5790 0.9580 -5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 0.9910 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.1110 -3.4240 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2010 -0.0660 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.8950 -14.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -2.9280 -11.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -4.1210 -12.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -2.8650 -11.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.6140 -8.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -1.5160 -5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 2.1870 -14.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 2.4710 -15.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 2.9550 -13.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 0.4500 -9.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 1.1330 -1.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 3.6780 2.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 5.6600 0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 0.3080 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -1.3240 -3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -0.5340 -11.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 0.6560 -5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 0.8170 -7.6980 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0 0 4.7580 -1.2770 -7.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 0.4860 -7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -1.4710 -5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -2.3790 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.3440 -7.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.1010 -7.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 0.9140 -5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 1.8480 -5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 0.1140 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 1.8740 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 2.0420 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -0.0190 -13.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 0.9380 -15.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 1.7600 -13.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -4.9030 -12.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -2.6170 -8.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -2.9030 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -3.3230 -8.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -1.6200 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -1.4040 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -2.4040 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 3.3010 -15.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.3100 -9.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 1.2760 -9.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 0.6760 -10.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 4.5290 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 6.0830 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.4900 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 0.4410 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.2350 -4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.5520 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -1.1620 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.1580 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 43 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 57 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 11 60 1 0 0 0 0 11 61 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 62 1 0 0 0 0 12 63 1 0 0 0 0 13 14 1 0 0 0 0 13 64 1 0 0 0 0 13 65 1 0 0 0 0 14 33 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 16 20 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 66 1 0 0 0 0 17 67 1 0 0 0 0 18 68 1 0 0 0 0 18 69 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 70 1 0 0 0 0 22 24 1 0 0 0 0 22 71 1 0 0 0 0 22 72 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 37 1 0 0 0 0 24 28 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 75 1 0 0 0 0 26 76 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 29 30 1 0 0 0 0 29 77 1 0 0 0 0 29 78 1 0 0 0 0 30 31 1 0 0 0 0 30 79 1 0 0 0 0 30 80 1 0 0 0 0 31 32 1 0 0 0 0 31 43 1 0 0 0 0 31 81 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 85 1 0 0 0 0 37 86 1 0 0 0 0 37 87 1 0 0 0 0 37 88 1 0 0 0 0 38 89 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 92 1 0 0 0 0 42 93 1 0 0 0 0 42 94 1 0 0 0 0 42 95 1 0 0 0 0 44 96 1 0 0 0 0 45 97 1 0 0 0 0 46 98 1 0 0 0 0 46 99 1 0 0 0 0 46100 1 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 M END > 533 $$$$ 534 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 0.5260 1.0320 -0.5830 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8940 -0.3230 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 0.7100 -0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.1440 1.8830 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6420 1.5980 3.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 2.7940 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 3.4010 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.2340 0.8470 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4240 2.6870 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 3.1320 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 2.0580 -1.3670 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2300 4.7310 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 5.1840 3.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 6.3630 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 6.8980 5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 6.9950 3.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 1.4450 -1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 1.9840 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 1.4020 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 2.9370 -3.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 2.0900 -4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 1.8300 -5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 0.5450 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -0.2330 2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -0.4630 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 0.4560 3.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -1.8670 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -1.8510 3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -1.4110 5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -3.2550 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 1.5310 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 3.5190 -4.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 4.2730 -5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 5.7650 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 3.7560 -6.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -1.1790 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -0.5330 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 1.7770 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 3.2830 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 4.1230 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 2.4760 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 5.4600 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 4.6250 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 6.1960 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 7.8600 5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 7.0250 5.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 0.3330 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 1.5590 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 0.7570 -6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 2.3200 -6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 2.2280 -5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -2.4950 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.2640 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 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1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 534 $$$$ 535 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 0.6850 1.4390 1.4460 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6180 -0.0870 1.2600 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0210 1.8310 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 0.7710 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.4820 1.2050 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3830 -1.5780 0.1760 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8040 -1.6700 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -0.5720 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 0.6670 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 1.8870 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -2.8470 0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -0.7600 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -0.9380 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -0.7210 0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 1.7810 2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 2.9600 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 3.3830 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 4.7540 4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 4.6440 4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 5.2390 6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 3.6810 2.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 1.4790 -0.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 2.4540 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3370 2.1070 -1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 3.6100 -1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -3.8910 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -5.2400 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -6.2810 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -5.8810 -2.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -3.7500 -1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -6.3840 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -7.6400 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -6.6920 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -6.3430 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -7.7040 -3.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 1.9240 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 2.8390 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.3200 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -0.6940 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 2.5300 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 2.4330 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -1.9190 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.4280 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.6530 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 3.4410 5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 5.4640 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 5.6210 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 4.2980 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 3.9340 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 5.3180 6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 6.2160 6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 4.5300 6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2100 2.0800 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 2.8600 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 1.1300 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -5.5230 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -5.1900 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -6.6840 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -7.1250 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -5.4150 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -7.6020 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -8.4060 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -7.8830 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -5.4030 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -6.2380 -5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -7.1340 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 15 1 0 0 0 0 1 36 1 0 0 0 0 2 5 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 22 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 33 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 535 $$$$ 536 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 81 0 0 1 0 0 0 0 0999 V2000 6.5670 2.9190 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9470 1.4550 -2.9040 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0000 0.7210 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 1.3260 -0.6960 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8720 2.8160 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 3.6070 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 0.8360 -3.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 0.8660 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -0.7620 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 0.6920 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3280 1.1030 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2320 0.5920 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7870 -0.5500 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5810 -1.1260 4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9770 -2.5270 4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 -3.1030 5.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5780 -3.4930 6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -4.0590 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -2.9470 8.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -3.5130 9.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 -3.0040 10.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -3.4790 12.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 3.4050 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 1.3930 3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -3.3770 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -1.9440 10.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 -4.5800 12.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 -5.0560 14.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4620 -6.3210 14.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -7.3010 13.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1620 -6.7970 15.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 3.4220 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 2.9710 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9240 1.4040 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0780 1.1440 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5870 3.6360 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 4.6220 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 1.2460 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 0.4370 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 0.3430 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 1.9220 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 -0.8650 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 -1.2840 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 -1.1910 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 1.0340 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 -0.3930 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2090 0.6800 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4080 2.1900 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -1.0790 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 -1.1860 5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9040 -0.4850 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 -2.4670 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6540 -3.1680 3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 -3.1930 6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -4.8440 7.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 -4.4750 7.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 -2.1620 8.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -2.5310 8.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -4.3370 10.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1260 -2.6450 13.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -3.8730 12.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9140 2.8160 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 4.4800 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 1.0310 4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 1.2830 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 2.4440 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -4.2760 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -3.2620 5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -2.5080 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -0.9640 10.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 -1.9630 11.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -2.1360 9.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 -5.4140 12.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0390 -4.1860 12.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -4.3530 14.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 -7.6320 13.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -8.1610 13.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 -6.8190 12.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -6.7360 15.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -7.8310 15.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 -6.1700 16.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 2 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 27 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 28 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 29 2 0 0 0 0 28 75 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 M END > 536 $$$$ 537 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 81 0 0 1 0 0 0 0 0999 V2000 -0.0210 -1.0270 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.5240 -3.5050 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3690 -0.3820 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 0.7530 -1.5420 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6580 0.5730 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -0.1980 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -1.4620 -4.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -1.6890 -1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -0.0520 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 0.7470 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 1.1620 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 1.7240 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 0.9500 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 1.4700 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 0.5760 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1950 1.0960 4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 1.5450 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2200 1.9790 6.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 3.4910 6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 3.9250 7.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3380 4.4980 7.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0030 5.0270 9.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 1.3370 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 3.1760 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 1.6260 5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0260 4.6270 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 3.9700 9.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 4.5000 10.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 3.8210 12.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8130 2.5110 12.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2220 4.3500 13.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.9600 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -2.0670 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.4450 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 1.7060 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.2470 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.6120 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -2.4990 -2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -1.5850 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -1.9140 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 1.0300 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -0.4450 -2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -0.5030 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 1.4480 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -0.2560 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 0.2930 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 1.9210 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 -0.0610 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 1.4650 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 2.4880 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 0.5810 3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 -0.4420 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 1.1000 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 1.7280 7.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 1.4670 6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0590 3.7420 5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 4.0030 6.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7030 3.7650 8.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5610 5.9310 8.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 5.2580 9.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 2.3230 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.7950 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.4470 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 3.2790 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 3.5470 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 3.7530 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 0.6580 5.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 2.3800 6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 1.8990 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6760 5.5290 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1030 4.6900 6.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7940 3.7560 5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4020 3.0660 9.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7190 3.7390 8.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1580 5.4390 10.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2660 1.8130 11.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 2.0960 13.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7700 2.6760 11.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5180 4.9760 13.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5330 3.5160 13.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0940 4.9420 13.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 27 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 28 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 29 2 0 0 0 0 28 75 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 M END > 537 $$$$ 538 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5170 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.4870 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 1.6300 -0.0740 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1110 2.2030 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 3.6610 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 3.9390 0.0540 C 0 0 0 0 0 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0 21 72 1 0 0 0 0 22 23 1 0 0 0 0 22 73 1 0 0 0 0 22 74 1 0 0 0 0 23 25 1 0 0 0 0 23 75 1 0 0 0 0 23 76 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 77 1 0 0 0 0 25 29 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 26 78 1 0 0 0 0 27 79 1 0 0 0 0 27 80 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 42 1 0 0 0 0 30 31 1 0 0 0 0 30 81 1 0 0 0 0 30 82 1 0 0 0 0 31 33 1 0 0 0 0 31 83 1 0 0 0 0 31 84 1 0 0 0 0 32 33 1 0 0 0 0 32 37 1 0 0 0 0 32 85 1 0 0 0 0 33 34 1 0 0 0 0 33 40 1 0 0 0 0 34 35 1 0 0 0 0 34 86 1 0 0 0 0 34 87 1 0 0 0 0 35 36 1 0 0 0 0 35 88 1 0 0 0 0 35 89 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 38 92 1 0 0 0 0 38 93 1 0 0 0 0 38 94 1 0 0 0 0 39 95 1 0 0 0 0 39 96 1 0 0 0 0 39 97 1 0 0 0 0 40 41 2 0 0 0 0 40 55 1 0 0 0 0 42 98 1 0 0 0 0 42 99 1 0 0 0 0 42100 1 0 0 0 0 43101 1 0 0 0 0 43102 1 0 0 0 0 43103 1 0 0 0 0 44104 1 0 0 0 0 44105 1 0 0 0 0 44106 1 0 0 0 0 45107 1 0 0 0 0 45108 1 0 0 0 0 45109 1 0 0 0 0 46110 1 0 0 0 0 46111 1 0 0 0 0 46112 1 0 0 0 0 47 50 1 0 0 0 0 47 51 2 0 0 0 0 49113 1 0 0 0 0 50114 1 0 0 0 0 52115 1 0 0 0 0 53116 1 0 0 0 0 55117 1 0 0 0 0 56118 1 0 0 0 0 M END > 544 $$$$ 545 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 92 0 0 1 0 0 0 0 0999 V2000 0.9010 2.4450 0.2330 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4970 0.9770 0.2140 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1990 0.1650 1.3040 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4120 2.6060 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 1.8680 1.2990 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6920 0.4060 1.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4340 -0.3550 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -0.3930 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 1.9220 1.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4870 1.0170 1.8830 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6180 3.3840 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 3.3600 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4010 2.3430 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 0.9740 1.3160 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8670 0.2660 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3290 0.4510 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8760 2.5970 0.6790 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6870 1.9310 1.7930 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1820 2.1240 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5800 1.5900 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7760 2.2720 -0.9350 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2810 2.0530 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1410 1.6240 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -1.3030 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 0.4120 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 0.8710 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 2.5720 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 1.5950 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 3.6810 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3510 2.5940 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 3.1300 1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.7750 0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -2.0380 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -3.1790 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0930 3.7380 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2180 4.5540 -0.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3500 4.1430 -1.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 3.5060 3.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9330 2.1720 4.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5630 2.8560 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 0.1490 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 2.9130 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 0.5460 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 2.2090 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 3.6680 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -0.0110 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 0.1120 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -1.3870 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -0.9550 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -0.9290 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 1.6080 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 4.3180 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 3.9730 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 3.8030 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 0.5590 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 -0.8190 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 -0.0380 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -0.0160 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 3.1830 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7410 1.5860 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6460 1.7750 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4090 0.5120 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0990 0.9780 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 2.5500 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9010 0.5610 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5740 2.1000 -3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2080 1.7500 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 0.0140 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -0.0860 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 1.4830 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.3200 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 2.7030 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 1.9710 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 3.5480 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 1.0290 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 2.6400 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 1.5250 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 3.1200 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -3.7910 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -3.4300 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -3.3700 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5050 5.0960 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 2.7510 5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1040 2.4170 6.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8160 3.9130 5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 0.6940 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 -0.0260 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -0.8070 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 10 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 51 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 52 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 18 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 35 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 32 1 0 0 0 0 24 33 2 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 26 71 1 0 0 0 0 27 72 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 75 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 30 38 2 0 0 0 0 30 39 1 0 0 0 0 31 78 1 0 0 0 0 32 34 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 34 81 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 82 1 0 0 0 0 39 40 1 0 0 0 0 40 83 1 0 0 0 0 40 84 1 0 0 0 0 40 85 1 0 0 0 0 41 86 1 0 0 0 0 41 87 1 0 0 0 0 41 88 1 0 0 0 0 M END > 545 $$$$ 546 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 88 92 0 0 1 0 0 0 0 0999 V2000 2.3410 2.9720 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 1.6230 -0.1550 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9060 0.6530 1.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8370 2.8020 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 1.9050 1.6170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3700 0.5710 1.3910 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6240 -0.3720 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.7040 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 1.5900 1.7050 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9320 0.5810 2.7870 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9600 2.4980 1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 2.8120 1.7630 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2970 1.0160 1.7670 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4160 0.2310 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -0.7390 3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3050 -1.0890 3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7950 0.8090 2.0070 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0690 0.2370 3.3920 C 0 0 2 0 0 0 0 0 0 0 0 0 11.5610 0.0000 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1200 -0.9310 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9100 -0.3180 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4190 -0.0600 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.8020 -0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.0250 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 2.6580 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 1.1150 4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 1.1930 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2520 1.8070 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -0.7370 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 0.1040 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 1.0950 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 3.5900 0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 0.5620 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6990 0.9820 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4070 -1.3140 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 0.8200 5.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0430 2.4580 4.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.6800 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 2.0410 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 2.2380 -1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 2.0980 -2.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 3.6240 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 3.4540 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 1.1960 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 2.3720 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 3.7960 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 0.0730 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -1.3080 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 -1.3800 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 -1.1850 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 3.0260 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 2.9000 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 3.4430 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 -1.3050 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5300 -1.5520 4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5690 -1.7560 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0900 0.9500 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 -0.4650 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1890 -1.0820 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6160 -1.8980 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9180 -1.0260 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 0.4500 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.9980 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 0.3150 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 2.0300 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 3.1360 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 1.9610 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 3.4190 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 0.4490 4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 2.1130 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 1.1610 4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -1.0200 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -1.4740 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 4.3900 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 0.9870 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 -0.5260 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 0.9030 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7620 0.7780 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5340 1.4000 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 1.6940 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8440 -2.2440 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2640 -0.8900 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4660 -1.5160 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 3.0320 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -1.5180 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 3.2950 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 1.8950 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 1.6650 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 44 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 10 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 31 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 32 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 39 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 27 36 2 0 0 0 0 27 37 1 0 0 0 0 29 38 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 32 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 37 84 1 0 0 0 0 38 85 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 86 1 0 0 0 0 40 87 1 0 0 0 0 40 88 1 0 0 0 0 M END > 546 $$$$ 547 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 84 88 0 0 1 0 0 0 0 0999 V2000 0.7820 2.3540 0.1500 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3510 0.9010 0.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9560 0.0000 1.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2970 2.4860 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 1.6570 1.3510 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4510 0.2100 1.1940 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1040 -0.6500 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -0.6850 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 1.7130 1.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2020 0.7190 2.0470 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4260 3.1550 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 3.1280 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 2.0980 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 0.7120 1.6040 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5580 -0.0040 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 0.1450 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 2.2480 1.0210 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4270 1.6250 2.1910 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9300 1.7600 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3150 3.2260 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5400 3.8640 0.6220 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0340 3.7120 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 0.1630 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 2.2770 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 2.3050 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.4330 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -0.1390 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 1.4920 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 3.2260 3.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6020 1.8880 4.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8980 1.6950 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 1.1570 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8730 5.3390 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 2.9850 1.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 0.8210 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 3.2280 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -0.0630 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1420 5.7340 0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3880 7.1650 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9980 6.1610 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -1.6370 -0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 2.8860 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 0.5280 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 2.1400 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 3.5340 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -0.2580 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -1.6750 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -1.3330 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -1.1180 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 4.1120 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 3.8220 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 3.4660 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 0.3160 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 -1.0810 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6390 -0.3290 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 -0.3390 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4590 1.3580 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2180 1.1770 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1340 3.7860 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3870 3.2860 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 4.1080 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 4.2980 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -0.2240 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.3890 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 1.2190 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 2.4210 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 1.6140 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 3.2400 2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -2.2640 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 2.3560 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 0.5280 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 2.1970 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 1.0580 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 3.0000 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 1.3260 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7290 2.1600 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3860 3.6920 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0130 3.3780 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 0.4260 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 -0.0800 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -1.0840 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0810 7.6100 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4510 7.3470 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8180 7.6110 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 43 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 36 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 41 2 0 0 0 0 26 69 1 0 0 0 0 30 70 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 32 73 1 0 0 0 0 33 38 1 0 0 0 0 33 40 2 0 0 0 0 34 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 37 79 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 38 39 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 M END > 547 $$$$ 548 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 85 89 0 0 1 0 0 0 0 0999 V2000 1.7560 3.2070 0.1290 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7960 2.1450 -0.3790 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6810 0.9640 0.5890 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1240 2.6200 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 1.4820 1.4740 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0430 0.4420 0.9790 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9750 -0.7220 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -1.4440 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 0.8220 1.5530 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4590 -0.5050 2.3010 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7950 1.0660 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 1.7660 2.1740 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9500 -0.2210 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.1930 2.0870 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9810 -2.3900 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 -2.9570 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -0.7900 2.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4220 -1.8690 3.3080 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8270 -2.4690 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 -1.3860 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7950 -0.2860 2.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3840 0.3040 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 1.3160 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 2.0780 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0920 -1.2830 4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.1380 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 0.0200 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 0.6400 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -0.1050 4.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 -2.0690 5.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -1.2510 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -0.2510 3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7660 0.8120 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 3.9440 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 2.7190 -0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1880 -0.8430 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -1.7160 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0770 0.5420 3.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9500 1.6440 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3630 1.9330 3.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.0510 -1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 2.9070 1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 3.9340 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 1.7660 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 2.2400 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 3.4240 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.3910 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.4330 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -2.3110 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -1.7840 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6670 1.6970 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 2.1120 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 -2.1820 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 -3.1840 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -3.7640 3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -3.3490 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8680 -3.2030 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0260 -2.9890 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 -0.9530 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8710 -1.8460 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3450 1.0330 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 0.8330 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 1.4600 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.5050 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 2.2340 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 2.7010 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 1.2750 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 2.6860 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.0860 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8540 -1.6480 6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -1.1770 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 0.5050 4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 0.0990 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 4.4120 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 3.4470 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5070 -1.6500 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1300 -0.0510 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2070 -1.2280 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -0.8820 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8170 -2.2100 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -2.4280 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8740 2.4290 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6530 2.0400 4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9800 1.2900 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 3.5420 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 44 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 10 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 51 1 0 0 0 0 12 42 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 18 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 36 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 41 2 0 0 0 0 26 69 1 0 0 0 0 30 70 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 32 73 1 0 0 0 0 33 38 1 0 0 0 0 33 40 2 0 0 0 0 34 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 37 79 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 38 39 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 42 85 1 0 0 0 0 M END > 548 $$$$ 549 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.0560 1.5920 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 1.9310 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2680 1.3480 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 0.1430 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -1.1380 0.9710 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0460 0.0430 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.8140 1.0280 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0860 -2.1870 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -2.1370 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -0.6590 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.0820 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -2.2520 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 3.4310 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 4.0700 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 4.1900 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 3.5430 2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 5.4000 1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.4060 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.9700 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.9880 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 1.5750 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 2.0520 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 1.0540 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 0.2360 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 0.0730 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -1.4590 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -3.0150 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.2410 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -2.5840 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -2.6440 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -0.8910 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 0.5630 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 0.5010 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -1.9750 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -2.3960 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -3.1780 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 5.1450 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 3.5120 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 4.0840 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 39 1 0 0 0 0 M END > 549 $$$$ 550 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2410 1.7940 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.3040 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.4980 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 2.0430 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 1.2910 1.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3550 -0.2170 0.9520 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1830 -0.9340 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -0.5940 2.0550 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8240 0.9250 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 1.6000 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -1.3970 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.6880 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 -1.2400 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -2.7580 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -0.8970 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -1.7430 2.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -0.5120 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 2.3630 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 2.1200 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 0.1220 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0050 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 1.6850 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 3.1100 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -0.9700 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 1.2820 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 1.1780 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.2190 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 2.6780 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -2.1280 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -1.4060 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.4310 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 1.1540 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 2.7620 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -0.8620 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -3.1360 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -3.2180 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -3.0030 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 0.1850 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 -1.3570 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -1.2750 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 6 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 M END > 550 $$$$ 551 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 94100 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 1.3600 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 1.5190 -0.4820 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4430 2.3350 -1.3290 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6580 2.7390 1.5300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9510 3.7510 0.6650 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3850 3.7830 -0.8180 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1960 4.4640 -1.5420 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0030 4.4220 -0.5490 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9490 5.8360 0.0750 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0690 5.1350 1.2830 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3680 6.2290 0.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4080 5.2140 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 7.3860 1.5010 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7600 6.6240 2.7500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3370 8.4090 1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 9.6700 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 10.7660 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 9.9060 2.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 12.0740 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 13.0930 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 12.8210 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 11.5270 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 10.5000 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 6.7660 -0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 4.3150 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 2.2820 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 5.4660 1.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 7.2960 3.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 6.3970 2.5420 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0920 5.8830 1.1660 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4480 3.3960 0.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0510 1.7190 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.0330 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6180 0.2400 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 2.5850 2.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 2.3730 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 6.5370 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 7.4410 -2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 3.1610 5.1010 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 7.8200 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 12.2870 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 14.1050 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 13.6220 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 11.3220 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 9.4900 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 2.8510 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 2.7120 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 6.3380 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 6.8370 4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 5.6510 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 6.5980 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 3.4890 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 1.9900 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 0.6200 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 -0.3410 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 2.2670 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 1.4670 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 3.2250 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 8.2180 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 6.8580 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 7.9030 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 4.7040 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 8.3580 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 6.8370 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 6.8310 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 5.3070 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 5.6490 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 4.3660 -4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 1.2990 -5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 1.1600 -4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -0.2980 -4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 51 1 0 0 0 0 2 52 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 56 1 0 0 0 0 5 8 1 0 0 0 0 5 28 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 58 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 59 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 13 15 1 0 0 0 0 13 60 1 0 0 0 0 14 16 1 0 0 0 0 14 61 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 63 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 25 2 0 0 0 0 21 22 2 0 0 0 0 21 64 1 0 0 0 0 22 23 1 0 0 0 0 22 65 1 0 0 0 0 23 24 2 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 25 68 1 0 0 0 0 26 39 1 0 0 0 0 28 42 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 31 32 1 0 0 0 0 31 44 1 0 0 0 0 31 73 1 0 0 0 0 32 43 1 0 0 0 0 32 74 1 0 0 0 0 33 35 1 0 0 0 0 33 75 1 0 0 0 0 34 35 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 36 78 1 0 0 0 0 37 38 1 0 0 0 0 38 79 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 82 1 0 0 0 0 40 83 1 0 0 0 0 40 84 1 0 0 0 0 42 48 1 0 0 0 0 43 85 1 0 0 0 0 44 45 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 45 88 1 0 0 0 0 46 47 1 0 0 0 0 47 89 1 0 0 0 0 47 90 1 0 0 0 0 47 91 1 0 0 0 0 48 92 1 0 0 0 0 48 93 1 0 0 0 0 48 94 1 0 0 0 0 M END > 551 $$$$ 552 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 18 17 0 0 0 0 0 0 0 0999 V2000 -0.0320 1.3270 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.0090 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.0320 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.7770 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.7250 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -1.2080 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -1.8770 -1.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.9940 -2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -0.8820 0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -1.3140 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 1.4180 -0.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 3.3580 -0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.8850 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -1.5770 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.0410 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -2.1670 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -1.3950 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 3.7760 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 13 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 11 2 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 9 17 1 0 0 0 0 12 18 1 0 0 0 0 M END > 552 $$$$ 553 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 18 17 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.3210 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.0190 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.8460 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 2.1500 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -0.6760 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.9240 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -0.5990 2.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -0.3160 0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -2.1900 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 -1.5040 1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 1.6260 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 3.4880 -0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 1.7910 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.6250 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -0.0240 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -2.6900 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -1.6420 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 3.9890 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 3 8 2 0 0 0 0 3 9 1 0 0 0 0 4 11 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 12 18 1 0 0 0 0 M END > 553 $$$$ 554 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 93 99 0 0 1 0 0 0 0 0999 V2000 0.4070 1.7470 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 0.7340 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 0.0830 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 0.4320 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 1.4350 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.0950 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 9.1110 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 9.1730 -1.9280 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1430 8.8740 -2.2370 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4560 7.7180 0.0690 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0630 7.2600 -0.3650 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7420 7.4580 -1.8510 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2240 7.4040 -1.9110 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7280 7.5090 -0.4580 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4060 6.0910 -0.0190 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9050 5.7780 0.0080 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5660 5.1970 -0.4310 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4980 3.9170 0.4060 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9130 4.4220 1.7800 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8980 5.5690 1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 10.4710 -2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 7.7240 1.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 8.0650 0.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5640 8.3350 -2.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 9.8550 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 6.0650 1.4400 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6850 5.0820 2.3850 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0200 7.3750 2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 3.3470 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 9.4780 -0.0380 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.2200 10.3560 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 6.6950 -2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 5.2060 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 4.9600 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 3.3900 2.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 4.0910 2.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 11.8130 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 9.1010 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 10.4550 -4.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 10.7740 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 7.8600 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 5.6580 -0.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 6.3490 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 6.0260 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 7.2290 0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.4530 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 2.2270 -1.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 4.4990 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 7.3550 2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 0.4600 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -0.7010 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -0.0800 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 1.7030 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 2.8780 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 9.8720 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 9.2820 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 8.4270 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 6.9990 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 6.3950 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 8.1610 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 3.1850 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 6.4640 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 5.2790 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 10.7280 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 7.9110 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 10.0190 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 10.8410 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 5.7770 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 5.6350 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 7.3940 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 10.1060 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 10.2230 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 3.6950 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 12.0640 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 11.9460 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 12.4660 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 8.9010 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 8.4300 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 11.8190 -5.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 10.6080 -5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 10.1370 -6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 8.6340 -3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 7.6140 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 6.9690 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 5.1590 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 6.8800 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 5.8040 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 3.6960 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 5.3890 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 4.7230 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 6.3470 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7730 7.3840 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 8.0530 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 46 1 0 0 0 0 2 3 2 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 51 1 0 0 0 0 4 5 2 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 53 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 57 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 58 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 59 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 60 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 19 35 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 64 1 0 0 0 0 22 49 1 0 0 0 0 23 30 1 0 0 0 0 23 65 1 0 0 0 0 24 41 1 0 0 0 0 25 30 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 68 1 0 0 0 0 27 36 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 31 37 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 35 73 1 0 0 0 0 36 48 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 37 76 1 0 0 0 0 38 39 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 39 40 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 41 82 1 0 0 0 0 41 83 1 0 0 0 0 41 84 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 2 0 0 0 0 44 85 1 0 0 0 0 44 86 1 0 0 0 0 44 87 1 0 0 0 0 46 47 2 0 0 0 0 48 88 1 0 0 0 0 48 89 1 0 0 0 0 48 90 1 0 0 0 0 49 91 1 0 0 0 0 49 92 1 0 0 0 0 49 93 1 0 0 0 0 M END > 554 $$$$ 555 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0890 1.6930 0.0640 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1780 0.1570 0.0940 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1910 -0.2900 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 0.7190 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 2.0550 0.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9500 3.7250 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 4.3950 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 3.7820 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 2.2750 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 2.2340 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 2.8280 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 5.8880 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 4.3160 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 2.2080 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -0.2960 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -0.2370 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.2040 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -1.3080 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 0.8040 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 0.4180 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 2.6440 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 4.2720 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 3.9610 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 4.2400 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 2.0920 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 1.8090 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.9880 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 1.7770 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 6.1850 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 6.1740 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 6.3860 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 4.5130 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 4.7880 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 4.7220 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 1.1530 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 2.7510 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 0.1070 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -1.3850 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 0.0680 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 11 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 M END > 555 $$$$ 556 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.2790 1.4380 0.0590 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4360 -0.0870 -0.0740 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7950 -0.3880 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.8250 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 2.0210 0.2310 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6890 1.2600 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 1.4260 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.7710 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 2.0050 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 2.9740 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 0.8880 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 4.4340 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 2.5320 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -0.8090 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 1.2100 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.3780 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -0.4280 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -1.3160 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 0.9740 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 0.6860 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 2.5360 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 1.7770 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 0.2450 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 1.3540 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 1.1990 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 2.8350 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 3.0670 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 1.8620 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -0.1910 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 1.3780 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 1.2430 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 4.9670 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 4.8500 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 4.5430 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 1.4720 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 3.2280 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -0.6400 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -1.8780 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -0.4230 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 10 1 0 0 0 0 5 21 1 0 0 0 0 6 9 1 0 0 0 0 6 15 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 M END > 556 $$$$ 557 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.3220 1.5290 -0.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 0.0330 -0.0800 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2500 -0.6080 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 0.2290 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 1.6420 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 2.1850 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 1.9490 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 2.2850 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 2.0940 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 2.2420 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.3830 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 2.1260 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 2.7430 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 2.6740 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 4.0800 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -0.2190 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.6600 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.4800 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -0.0490 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 0.1210 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 2.3070 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 0.9140 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 2.6060 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 1.9700 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 3.3580 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 3.0880 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.4430 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 2.3650 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 1.3380 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 3.1050 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.4110 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -1.2970 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.5610 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 2.0960 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 3.6820 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 2.1920 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 3.9280 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 4.6500 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 4.6290 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 13 2 0 0 0 0 6 9 1 0 0 0 0 6 12 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 M END > 557 $$$$ 558 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.2440 1.5830 0.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0100 0.0830 -0.1670 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2760 -0.5950 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 0.4110 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 1.7760 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 2.0210 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 2.0730 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 2.0280 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 2.3920 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 2.1360 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -0.3840 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 2.0750 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 2.9080 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 2.9380 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 4.1790 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -0.1230 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.6990 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -1.5620 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 0.3050 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 0.2640 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 2.7210 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 1.0120 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 2.1050 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 1.3240 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 3.0190 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 3.4570 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 2.1560 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 2.1710 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 3.0300 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 1.2520 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 0.0600 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -1.4710 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.0750 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 2.5860 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 3.9590 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 2.2910 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 3.9720 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 4.5680 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 4.9170 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 13 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 M END > 558 $$$$ 559 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.0990 1.3110 -0.0890 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3740 -0.2050 -0.0120 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7350 -0.3070 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 0.8980 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 2.0120 0.0110 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7780 1.7260 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 1.1290 0.9050 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7500 1.7060 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 1.8180 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.6400 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 2.0990 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 1.4850 2.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 2.8330 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 4.0320 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 3.3290 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.8030 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -0.7050 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -0.2050 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -1.2450 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 1.2010 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 0.6500 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 2.6580 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 1.3550 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 2.8140 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 0.0440 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 2.0460 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 1.7370 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 2.0090 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 2.5080 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 1.1380 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 2.2100 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 4.6730 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 3.6800 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 4.5970 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 2.4740 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 3.9140 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 3.9510 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.3220 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -1.8730 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -0.6390 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 13 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 M END > 559 $$$$ 560 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.8590 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.3240 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -0.2270 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 2.1350 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 2.3830 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -0.1590 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -0.5160 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 0.1870 0.8760 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0510 1.2150 1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 2.4580 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 2.6260 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -0.8490 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -1.3860 -0.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -0.8450 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0240 -1.8580 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 -0.1360 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 2.3480 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 2.2120 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -0.0900 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 0.0800 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 2.1340 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 0.1380 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 0.6920 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 0.7650 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 1.5120 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 2.4800 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 3.3560 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 1.7300 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 2.8630 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 3.4600 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.0820 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -1.6200 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.2950 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -1.3620 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 -1.3410 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 -2.5930 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -2.3630 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 0.5860 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1570 -0.8720 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 0.3810 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 6 2 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 M END > 560 $$$$ 561 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 32 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3870 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6780 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 2.0520 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7010 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 3.4800 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -2.1270 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -0.6270 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -2.0550 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.1930 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 2.3530 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.8870 -2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 3.0930 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -1.7580 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 3.8280 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 3.8830 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 3.8180 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -2.5580 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -2.4500 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.4600 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -2.4560 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -2.4040 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -2.3950 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 3.1770 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 1.6540 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 3.4380 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 2.4270 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 3.9500 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 M END > 561 $$$$ 562 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.3900 0.8590 -0.7550 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0390 1.3730 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 0.5250 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -0.4160 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.5440 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 1.5250 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 0.7730 0.1300 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8180 1.0200 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 2.0980 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 1.6970 -1.9850 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1130 2.9480 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 2.5520 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 3.9170 -3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 3.5830 -0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 0.4810 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.6160 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 2.0090 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.0350 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -1.3960 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -1.1030 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -1.0610 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 2.5850 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.0590 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 1.5440 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 0.1100 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 1.3990 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 2.0760 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 3.0870 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 1.1050 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 3.3100 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 2.4740 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 1.5910 -2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 3.4190 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 4.2320 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 4.7890 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 3.9600 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 1.2150 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -0.5150 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 0.7090 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.8090 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -0.6580 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -1.3680 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 M END > 562 $$$$ 563 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -2.1990 1.2380 -0.4000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9460 -0.2110 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -1.1360 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -0.9920 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 0.1200 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 0.6400 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 2.0010 0.8260 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4550 3.2300 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 3.6100 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 2.2530 -1.5450 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6300 2.3500 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.9880 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 3.3910 -3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 2.7390 -0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -2.3120 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 1.1330 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 0.4420 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.7980 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -1.7150 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 0.5150 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -0.2660 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.0160 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 1.4420 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 2.3210 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 2.9570 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 4.0440 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 4.1640 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 4.1930 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 1.9560 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.1250 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 0.5160 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.3540 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 3.0300 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 4.3270 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 3.5590 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 3.6160 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -2.8890 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.9440 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -1.9530 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 0.3280 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 1.7440 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 0.7080 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 M END > 563 $$$$ 564 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.1860 1.1280 -0.4400 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6010 -0.0700 -1.3060 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1350 -0.0200 -1.4330 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5910 0.7940 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 1.8730 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -1.3740 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0450 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.1250 -3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -2.4340 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -2.5460 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 0.6920 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 2.0530 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 1.4320 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 3.4120 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.9830 -4.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -3.6690 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 0.7810 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -1.0270 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 0.1630 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 1.2550 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 2.6900 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 2.2460 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -1.5080 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -1.3230 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.0020 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 0.9830 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -3.5290 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 1.7110 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 0.7170 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.1560 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 2.1860 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 1.6280 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 1.8700 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 0.3560 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 3.8540 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 4.0700 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 3.2790 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -3.8470 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.5260 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -3.5260 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 M END > 564 $$$$ 565 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.4460 2.9980 -0.8310 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8680 2.2130 -0.9730 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7940 1.2350 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 0.7870 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 2.1000 -0.0530 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0190 3.2990 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 4.1770 -2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 5.4350 -1.2080 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5140 5.0450 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 4.2970 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 2.7470 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 1.7680 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 3.1010 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 3.8790 -2.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 6.0730 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 0.8960 0.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 1.4670 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 2.8750 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 0.3470 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 0.0870 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.9200 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 2.3690 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 3.8220 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 6.1370 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 4.4010 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 5.9440 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 4.9260 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 4.0640 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.6540 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 0.8310 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 2.1970 3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.5790 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 3.6550 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 3.7130 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 2.1850 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 6.3240 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 6.9800 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 5.3710 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.7680 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 0.9190 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 2.1820 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 16 2 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 11 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 M END > 565 $$$$ 566 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.3080 2.1510 0.0340 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0140 0.7170 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -0.1530 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 0.6370 -0.5600 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8080 2.1110 -0.3150 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0640 2.9290 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 4.3530 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 4.9190 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 4.1460 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 2.6670 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 0.1740 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 2.4620 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 5.0030 -2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 6.3980 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.2320 -0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -0.1800 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -1.0580 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 2.8830 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.6060 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.4740 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 0.5050 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 2.9060 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 2.5230 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 4.6020 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 2.1680 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 2.4720 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 0.9760 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 2.4100 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 3.4640 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.7350 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 6.5930 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 6.7340 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 6.9350 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.8980 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -0.6170 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 0.7220 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -0.8120 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -1.3720 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 -1.8660 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 M END > 566 $$$$ 567 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5160 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3710 2.1520 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1800 1.4980 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 0.0790 3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 1.5420 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 2.1910 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0140 0.9260 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0150 -0.6370 0.9250 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1830 -2.1340 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.7460 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -1.9940 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -0.5560 2.0160 N 0 0 3 0 0 0 0 0 0 0 0 0 3.1770 -0.2080 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 0.4560 -1.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0920 1.8570 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 2.7480 -2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 0.5660 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.5500 -1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.5580 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.1510 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.8710 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8600 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.3050 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 3.2440 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -0.4350 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 0.0440 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 2.0550 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 1.5800 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 3.2510 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.6040 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -2.2810 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -2.7330 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -3.7830 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -2.2840 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -2.3150 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 0.1820 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -1.2830 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -0.4300 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 1.0400 -3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 1.1670 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -0.3050 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 9 1 0 0 0 0 2 19 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 25 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 M END > 567 $$$$ 568 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.3440 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -0.5490 0.3320 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6670 0.8760 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.9000 0.5210 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1630 0.0030 1.1800 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7630 -0.4370 1.1800 N 0 0 3 0 0 0 0 0 0 0 0 0 0.4900 -1.8110 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -2.8560 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -2.3610 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -0.9950 0.4150 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1690 2.0970 1.9800 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6680 0.1320 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 1.5740 2.9030 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4260 1.5140 2.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 1.6650 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -0.7900 1.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -1.0980 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 2.8620 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8920 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8810 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.3880 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.3640 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 2.9720 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 -1.2100 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 1.1640 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 0.8970 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -1.8570 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.0820 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -3.7320 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -3.1470 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -2.2800 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -3.0730 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 3.1860 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -0.1410 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.5380 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 2.2140 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 1.6260 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 1.0060 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 2.6920 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 1.3620 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -0.5160 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 9 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 19 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 14 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 20 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 18 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 M END > 568 $$$$ 569 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6960 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -0.6440 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 2.1400 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 1.4030 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -0.0080 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -0.4400 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 0.5950 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 1.7540 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 3.4950 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 4.1380 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 3.4640 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 4.0810 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.6910 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0800 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.0570 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -2.7000 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9140 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 0.5030 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 2.7480 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 3.8290 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 5.2190 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 3.8550 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 3.7790 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 3.7700 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 5.1650 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 0.7040 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 0.7140 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.5890 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -2.4050 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -2.4040 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -3.7810 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 6 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 10 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 M END > 569 $$$$ 570 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6960 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4090 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0010 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -0.6350 -0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1160 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 1.3350 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.0770 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 1.2000 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 1.9590 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -0.1740 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -0.8190 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -2.2640 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 -2.9690 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0160 -2.2600 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -0.9010 2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 3.2810 -0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 3.3020 0.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 -2.9940 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -2.2930 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8570 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 3.8580 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9090 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.7760 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9500 1.6770 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -2.7480 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -4.0270 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -4.0220 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8910 -2.4900 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 -2.9920 3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 -1.7910 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6220 -1.7820 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 -3.3280 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -2.0920 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -1.7080 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -2.6800 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 3.4190 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 4.9370 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 3.6410 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 6 2 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 10 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 19 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 29 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 20 24 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END > 570 $$$$ 571 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 38 0 0 0 0 0 0 0 0999 V2000 -1.1860 1.5160 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 0.1520 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.3440 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.5370 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 1.9210 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 2.4140 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 3.8530 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 4.4080 1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 4.6470 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.9890 -0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 2.7740 1.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.0100 1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.7700 2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -1.6800 0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -0.7980 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -1.0350 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.2570 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -3.4200 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -2.5010 -3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 2.1420 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 4.5900 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 5.6880 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 4.2380 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 3.0720 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -1.0550 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.0180 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -1.7450 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -0.3680 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.1970 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -3.7120 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -4.2600 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -3.1280 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -2.4850 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -3.4730 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -1.7220 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 2.5280 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 1.1760 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 2.8400 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 20 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 M END > 571 $$$$ 572 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -1.0270 1.0090 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -0.2800 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.6370 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 0.3250 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 1.6170 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 1.9780 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 3.3440 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 4.1630 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 3.7340 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 1.3400 -0.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 2.5370 0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -1.8420 1.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -1.3120 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -2.0100 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -3.3160 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -4.1140 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -4.0220 -2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 1.8140 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -0.3500 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -1.6460 1.9850 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9390 -2.8190 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -2.5160 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.0880 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -3.0120 0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 3.4760 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 4.8090 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 3.2020 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 2.5820 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -2.0430 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -0.8240 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -1.4320 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -4.2910 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -5.0690 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -3.5590 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -3.2860 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -4.5880 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -4.7010 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 2.7150 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 2.0430 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 1.0460 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -0.5790 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 0.2650 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -1.5060 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -2.3690 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -3.3520 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.6120 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -4.3520 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -4.9040 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -3.9120 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -3.7420 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 18 1 0 0 0 0 11 28 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 M END > 572 $$$$ 573 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 50 0 0 0 0 0 0 0 0999 V2000 -1.1780 1.5170 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.1530 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.3440 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 0.5350 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.9190 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 2.4130 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 3.8530 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 4.4070 1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 4.6490 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 1.9910 -0.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 2.7720 1.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0070 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -1.6800 0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.7970 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -1.0310 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -2.2530 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -3.4170 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -2.4950 -3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 2.1440 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 0.9500 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -1.1900 1.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 0.1460 2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 -0.5640 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 1.0920 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 4.0040 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 5.0450 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 5.4730 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 3.0700 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -2.0180 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -1.7440 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -0.3660 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.1920 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.7090 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -4.2570 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -3.1260 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.5420 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.9940 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -3.1240 -4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 2.5310 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 1.1770 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 2.8410 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.6280 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 1.5260 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -0.5930 3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 0.1750 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -1.1370 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -1.2380 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 1.5980 4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 0.5190 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 1.8310 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 19 1 0 0 0 0 11 28 1 0 0 0 0 12 20 1 0 0 0 0 12 21 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 M END > 573 $$$$ 574 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 -0.0010 1.3790 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0030 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0090 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.3910 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.5550 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 4.1560 1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 4.3150 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 2.0450 -0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 2.0680 0.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.0440 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.7700 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -1.0200 -1.9190 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9380 2.3550 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -1.8910 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -3.0940 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 -1.3790 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 0.2270 -2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -0.5320 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 3.6160 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 4.8680 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 5.0120 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 2.2700 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.4320 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.7240 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -0.1920 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -1.5200 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 1.4330 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 2.9830 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 2.8870 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -3.7180 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -3.4610 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -0.3680 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -1.3680 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -2.0310 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 0.7280 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 15 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 M END > 574 $$$$ 575 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.9770 1.7230 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 0.3880 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.0490 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.7570 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.0290 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 2.6030 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 3.5870 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 2.2210 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 3.9790 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 4.4800 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 5.9220 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 6.4820 1.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 6.7140 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 4.0670 -0.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 4.8270 1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 1.2730 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 0.9970 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -0.2370 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -1.3770 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -0.5180 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 4.2600 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -1.5260 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 0.1200 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 0.3040 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 2.6240 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 6.0630 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 7.1200 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 7.5310 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 5.0980 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 0.3380 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 1.7200 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 1.8180 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -1.6460 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -2.2370 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -1.0730 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -0.5270 -3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -1.4880 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 0.2580 -3.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 3.3080 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 4.9720 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 4.6460 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.1150 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -1.8630 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -1.6520 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 1.1700 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.2130 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.4770 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 8 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 14 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 21 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 M END > 575 $$$$ 576 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 2.2780 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 2.4390 1.3930 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2000 -0.6220 0.7260 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2180 -0.5670 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -2.0250 1.0810 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7260 -2.0580 1.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4830 1.1710 1.9040 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3740 0.1100 2.0490 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8320 -0.7270 3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 0.0640 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 1.2460 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -2.3900 2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -3.1870 0.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -2.9690 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -0.5990 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.3640 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 2.1480 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.1660 5.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 2.1810 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 3.4610 1.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 4.7320 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 5.8480 1.4740 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7600 5.3940 2.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 6.2740 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 7.0400 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 8.3740 2.2300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 4.9820 1.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 1.7570 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.2670 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 2.7620 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -0.0060 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.5490 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -2.7020 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 0.8180 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 0.5920 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -2.3620 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -2.5900 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -3.6430 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 1.5950 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 3.2280 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 2.1190 4.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 3.0000 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 5.1060 2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 6.6210 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 7.0810 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 5.4250 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 7.3860 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 6.7360 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 19 2 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 9 1 0 0 0 0 3 22 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 35 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 13 21 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 29 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END > 576 $$$$ 577 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 83 0 0 1 0 0 0 0 0999 V2000 -1.0330 -1.9530 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -2.8650 0.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.8200 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.7290 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -1.9000 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -3.6420 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -3.6040 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -4.4070 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -1.0530 -2.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -1.5560 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -4.5780 2.1030 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5730 -5.7920 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -6.1520 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -7.2690 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -8.0340 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -7.6780 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -6.5410 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -6.1880 0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -8.4800 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -9.5680 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -8.2710 -2.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -2.6810 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -1.6500 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -3.4720 -1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -9.1250 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -5.0110 2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -4.0680 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -3.7750 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -3.1140 4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -4.1910 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -5.4070 2.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -1.0720 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 0.2370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 0.6610 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -0.1000 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 1.9080 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -7.6480 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -6.9660 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -7.6680 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 -9.1150 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -7.0290 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -3.5080 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -5.2290 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.8530 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -0.7800 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.4200 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -5.5640 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -9.6670 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -10.5120 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -9.3130 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -0.9790 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -2.1490 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -1.0770 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -8.9390 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -5.6600 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -5.5510 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -3.0680 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.8200 5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.2330 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.8180 4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -4.7400 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -3.3020 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -4.8270 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -4.6880 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -0.8850 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -1.5680 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 0.8260 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -0.9190 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 0.5710 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -0.5020 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 2.7750 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 1.8320 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 2.0190 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 -8.7290 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -7.3350 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -5.8990 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 -9.3740 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0480 -9.2730 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -9.7450 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 -7.1540 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6740 -7.5040 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8010 -5.9660 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 2 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 4 22 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 25 54 1 0 0 0 0 26 28 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 36 73 1 0 0 0 0 37 38 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 38 39 2 0 0 0 0 38 76 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 40 77 1 0 0 0 0 40 78 1 0 0 0 0 40 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 41 82 1 0 0 0 0 M END > 577 $$$$ 578 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 9 8 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -0.5970 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 2.1460 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9920 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.6590 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.6190 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.2260 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 M END > 578 $$$$ 579 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 105113 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.5730 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -0.1240 -1.2070 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1470 1.4060 -1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 1.9530 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6860 1.8860 1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3810 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 1.8350 -1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.6450 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 0.2060 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 1.5400 1.2400 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8270 2.6610 1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -0.2100 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 0.9080 2.6800 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2070 2.3300 2.3610 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2900 3.3210 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6710 2.9550 2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 0.5000 2.7320 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1240 1.5320 2.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0580 -1.1450 1.0680 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4070 -0.9630 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2140 -0.1710 0.9380 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6460 1.2740 1.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.8390 2.1310 0.5830 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9000 -0.1210 -0.4300 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.6010 1.2450 -0.4470 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.7630 0.2220 -0.6890 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.2330 -1.1900 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7480 -1.3010 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0 0 0 0 0 0 0 0 0 -3.3620 3.5620 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 4.6780 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 4.1640 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3540 0.3480 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2660 2.8700 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7630 1.8580 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4170 3.0090 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -1.8310 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1580 -2.4680 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8480 -0.7430 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -5.0180 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -5.5310 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9030 -5.0930 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5610 3.1640 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 55 1 0 0 0 0 6 8 1 0 0 0 0 6 56 1 0 0 0 0 7 12 1 0 0 0 0 8 57 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 60 1 0 0 0 0 11 61 1 0 0 0 0 12 13 1 0 0 0 0 12 62 1 0 0 0 0 13 16 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 63 1 0 0 0 0 14 64 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 66 1 0 0 0 0 17 67 1 0 0 0 0 18 20 1 0 0 0 0 18 68 1 0 0 0 0 18 69 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 37 1 0 0 0 0 20 24 1 0 0 0 0 20 70 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 36 1 0 0 0 0 21 71 1 0 0 0 0 22 72 1 0 0 0 0 22 73 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 25 74 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 50 1 0 0 0 0 27 31 1 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 29 30 1 0 0 0 0 29 76 1 0 0 0 0 29 77 1 0 0 0 0 30 45 1 0 0 0 0 30 78 1 0 0 0 0 32 40 1 0 0 0 0 32 42 1 0 0 0 0 32 49 1 0 0 0 0 32 79 1 0 0 0 0 33 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 36 46 1 0 0 0 0 37 87 1 0 0 0 0 37 88 1 0 0 0 0 38 89 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 39 92 1 0 0 0 0 39 93 1 0 0 0 0 39 94 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 95 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 44 96 1 0 0 0 0 44 97 1 0 0 0 0 44 98 1 0 0 0 0 45 99 1 0 0 0 0 45100 1 0 0 0 0 45101 1 0 0 0 0 46 47 1 0 0 0 0 46 48 2 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 47104 1 0 0 0 0 49105 1 0 0 0 0 M END > 579 $$$$ 580 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 83 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4360 -0.5240 0.0920 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0970 0.0410 1.3520 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0550 1.4690 1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 2.0140 1.2740 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6030 -0.4670 -1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -1.5680 -0.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.5920 -0.6270 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9260 -1.0040 -1.9830 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7830 -1.1550 -2.9910 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7750 -2.1760 -2.4540 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2810 -1.7190 -1.0800 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4780 -0.4970 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -0.0010 -2.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -1.6110 -4.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -3.4530 -2.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 3.5410 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -0.3940 1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 4.0010 2.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 2.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 3.2160 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 3.7670 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 3.8170 -1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 4.9610 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 5.5330 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 6.7700 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 7.3020 -1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 6.6080 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 5.3810 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 4.8450 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 7.1340 -1.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 8.5030 -2.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.9510 0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -0.0140 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -0.5300 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 -0.1290 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 1.0740 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 1.4440 5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 0.6020 6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 -0.6030 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -0.9690 4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 0.9610 7.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2940 2.6280 5.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8900 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3660 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -0.2030 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -0.3130 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 1.6860 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 0.3780 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -1.9530 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -0.1940 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.2490 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -2.4630 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -1.4660 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 0.2480 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -0.2050 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 0.1520 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -1.7350 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -4.1490 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 3.9550 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 3.8660 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 4.9620 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 3.2330 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 5.4950 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 7.3060 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 4.8470 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 3.8910 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 7.6960 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 9.2610 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -2.3490 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -0.4430 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 1.0730 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 -0.1010 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -1.6170 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 1.7260 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -1.2580 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -1.9080 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1690 0.6660 7.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2200 2.5720 4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 6 18 1 0 0 0 0 6 49 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 53 1 0 0 0 0 13 54 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 14 57 1 0 0 0 0 15 58 1 0 0 0 0 16 59 1 0 0 0 0 17 60 1 0 0 0 0 18 20 1 0 0 0 0 18 61 1 0 0 0 0 18 62 1 0 0 0 0 19 35 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 23 64 1 0 0 0 0 25 26 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 34 71 1 0 0 0 0 35 36 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 36 37 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 76 1 0 0 0 0 39 40 1 0 0 0 0 39 44 1 0 0 0 0 40 41 2 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 41 77 1 0 0 0 0 42 78 1 0 0 0 0 43 79 1 0 0 0 0 44 80 1 0 0 0 0 M END > 580 $$$$ 581 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 0.8900 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 1.9960 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -0.3610 -0.4700 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0830 -0.5080 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -1.4570 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -1.5660 0.3890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4880 -2.8680 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.5470 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.6000 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 2.3440 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.0290 2.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 1.1210 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 0.7400 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 3.0500 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.3340 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -1.0300 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -1.5340 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -2.8900 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -2.9250 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -3.7170 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.2420 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -1.6870 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -0.2940 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 2.5400 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 3.2890 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 1.8080 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 M END > 581 $$$$ 582 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 24 25 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.6620 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -0.0380 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 2.1240 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0680 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.3450 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 2.2920 -0.0180 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9710 3.6530 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 3.5480 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 2.4030 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -0.6110 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 2.2980 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 3.0800 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 1.5330 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 1.9510 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 3.7700 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 4.4730 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 3.9670 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 4.0620 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 3.1440 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 1.4360 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 2.7080 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 2 0 0 0 0 4 7 1 0 0 0 0 4 13 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 M END > 582 $$$$ 583 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 0.4450 2.3060 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.0610 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.1600 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 2.0890 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 0.7010 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -0.5090 -0.2080 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6980 -1.6070 -1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -1.1830 -2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 0.2600 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -1.8890 -3.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 3.1240 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 2.1880 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -0.7900 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 2.6480 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 3.0760 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.1960 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -0.9520 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 0.8620 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 4.1260 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 2.9610 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 3.0230 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 1.6260 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 1.7750 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 3.2330 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.7190 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.8820 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.0300 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 M END > 583 $$$$ 584 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 0.1170 0.8430 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.6100 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -1.1580 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 1.5980 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.0860 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -0.3920 -1.2660 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8680 -0.5550 -2.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 0.7220 -3.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7860 1.7330 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 3.1030 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 1.3000 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -0.7880 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 0.7050 -2.7880 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5310 -0.3920 -3.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 2.0150 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.2780 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 0.9470 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -1.2760 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -2.2240 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 0.9570 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 2.8020 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 3.4490 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 3.6270 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 3.3040 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 0.2220 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 1.7480 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 1.7190 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -1.7430 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -0.0240 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -0.8760 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 0.5950 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -0.3230 -4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 2.8520 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 2.0030 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 2.1250 -4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 M END > 584 $$$$ 585 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3890 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6850 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4110 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0170 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -0.7130 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 0.0180 -0.7760 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0760 -0.6120 -0.5490 N 0 0 3 0 0 0 0 0 0 0 0 0 7.1200 0.0700 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 1.4840 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 1.4710 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 2.1450 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 3.4860 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 2.1420 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.0530 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 3.4810 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -0.6980 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -0.0600 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 3.4900 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 4.1600 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 5.4530 0.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 5.4590 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 4.3600 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7640 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1750 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -0.7760 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -1.7200 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -0.6300 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -0.4880 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 0.1090 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 1.4500 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 2.0770 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 4.0100 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 3.8290 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 3.8850 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 3.8190 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.8940 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 5.2910 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 6.3970 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 6 2 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 21 2 0 0 0 0 14 34 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END > 585 $$$$ 586 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 0.4710 0.6120 0.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2570 0.5160 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -0.0470 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -1.0850 -1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -1.7390 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -1.1700 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -1.8230 -1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8010 -1.0860 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 0.4020 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 1.1760 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 2.3060 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 2.5400 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.5450 1.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 0.5740 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 3.4910 2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -1.6260 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 -1.7270 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.6780 0.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -0.6660 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.5090 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -0.1370 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 0.4040 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -2.8150 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -1.5420 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -0.0940 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -1.3660 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -2.8990 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 0.8910 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 0.7780 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 0.6150 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 2.9510 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 0.9540 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 0.8430 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 -0.5110 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.3420 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.1210 -3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -0.8050 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2830 -2.0200 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9320 -1.0160 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -2.6100 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.2710 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.0370 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -1.6820 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 M END > 586 $$$$ 587 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4460 0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.4780 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 0.6100 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 1.9030 0.0230 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5380 -1.6590 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 0.4850 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 2.6320 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 1.9950 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 1.8940 1.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 1.3940 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -0.8810 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -1.1450 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -2.5320 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 -2.7960 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 -4.1830 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0100 -4.4480 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 -5.8340 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4950 -6.0990 -4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1340 -7.4850 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 2.5080 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 1.3620 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 2.8930 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 1.6440 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 3.0840 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.6470 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 1.7140 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 0.3040 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 1.7800 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -0.9240 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -1.6360 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -1.1010 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -0.3900 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -2.5760 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 -3.2870 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -2.7520 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 -2.0410 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 -4.2270 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 -4.9380 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3760 -4.4040 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7920 -3.6920 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2820 -5.8780 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 -6.5900 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -6.0550 -5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2770 -5.3430 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 -7.5290 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3520 -8.2410 -4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7360 -7.6740 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 5 21 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 M END > 587 $$$$ 588 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3870 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.1090 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4470 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.0400 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -0.6340 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 0.1020 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 1.5090 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 2.1420 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 2.0440 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 2.1620 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.0400 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -2.6820 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7720 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -1.0250 -1.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1570 3.4720 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -1.8950 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -0.4790 -1.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -2.7840 -2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -2.4530 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.1880 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -1.7130 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -0.3900 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -2.3980 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -2.3750 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -3.7640 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -1.7260 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -0.1950 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.0820 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 3.8700 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 3.8130 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 3.8230 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -3.4820 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -3.3410 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -2.1640 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -1.6290 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -3.0480 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -3.0790 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 6 2 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END > 588 $$$$ 589 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 72 74 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -4.6520 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 9.5870 1.3380 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6610 8.1660 1.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 7.7040 0.0030 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6550 8.2350 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 9.7650 -0.0690 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9760 10.2020 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 11.2210 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 10.3360 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 10.7190 2.3270 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0970 12.1800 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 13.0850 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 12.6510 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 10.3160 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 10.1370 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 9.9520 2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 10.2660 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 6.1740 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 13.4470 3.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 5.6450 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 4.1150 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -6.1820 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -4.3010 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -4.2910 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 8.0640 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 7.8460 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 7.9160 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 10.1560 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 11.2890 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 9.8600 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 10.8960 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 9.2940 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 12.5130 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 14.1310 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 9.3810 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 11.1120 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 11.0930 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 9.4170 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 10.0210 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 5.8230 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 5.8130 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 5.9960 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 6.0060 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 3.7630 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 3.7540 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 3.9370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 3.9460 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -6.5340 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -6.5430 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -6.5600 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 30 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 48 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 25 2 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 23 59 1 0 0 0 0 24 26 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 M END > 589 $$$$ 590 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 3.4790 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8370 4.0070 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4730 3.5460 -1.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4100 2.0190 -1.3350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0500 1.5930 -1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.9540 -0.0010 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8210 3.8420 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 5.4350 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.9710 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 1.5850 -2.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 2.6190 -6.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4380 3.4210 -7.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 2.0520 -5.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -1.9980 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -2.4850 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -1.6100 -4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -0.2470 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 0.2440 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -0.6360 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 0.7060 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 1.1540 -4.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 2.5950 -5.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 3.4390 -6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7940 4.1050 -6.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8210 3.9310 -5.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6660 3.0960 -4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 2.4270 -4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 0.7390 -3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 2.3970 -7.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.4090 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 3.9100 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 3.6160 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 3.9780 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 1.5880 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5220 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 4.7960 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 5.8370 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 3.7130 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -2.6840 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -3.5500 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -1.9930 -5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -0.2560 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 0.2040 -6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 1.5730 -5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9270 4.7580 -7.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7560 4.4510 -6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4780 2.9680 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3530 1.7760 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 2.8380 -8.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 1.7980 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 13 31 1 0 0 0 0 14 25 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 30 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END > 590 $$$$ 591 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4170 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1930 -0.0220 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0900 2.5760 1.4170 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4920 3.4730 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6130 2.6400 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 3.9540 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 4.3940 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 5.6480 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 6.4380 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 5.9900 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 4.7360 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 6.0900 -1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 6.8350 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 7.3790 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 8.0250 3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 8.8870 4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6800 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.0400 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -2.6660 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.0590 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7020 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9090 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.4880 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 1.6240 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 1.8800 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 3.0140 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 1.6430 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 3.3100 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 7.4040 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 4.3820 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 6.4850 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 7.3790 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 8.1300 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 7.6100 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 8.3750 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 8.3600 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 9.1050 5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 9.8200 4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -2.3580 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -2.3690 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -3.7490 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 0.6820 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.6920 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -0.6180 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 20 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 21 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 30 1 0 0 0 0 7 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M END > 591 $$$$ 592 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4170 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1930 -0.0220 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9970 2.6980 -1.4480 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5370 3.4140 0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 1.7700 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 4.0520 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 4.3830 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 5.5910 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 6.4440 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 6.1060 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 4.8980 -1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 5.9260 1.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6470 7.0210 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 7.1730 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 8.1670 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 9.1000 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6800 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.0400 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -2.6660 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.0590 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7020 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9090 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.4880 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 1.5860 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 2.8040 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 1.6480 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 0.7980 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 2.2030 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 7.3760 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 4.6290 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 6.7560 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 7.1690 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 7.9840 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 7.3180 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 8.4320 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8170 8.5910 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 9.3990 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1700 9.9830 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -2.3580 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -2.3690 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -3.7490 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 0.6820 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.6920 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -0.6180 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 20 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 21 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 30 1 0 0 0 0 7 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M END > 592 $$$$ 593 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 69 0 0 1 0 0 0 0 0999 V2000 0.0600 1.8600 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 2.4160 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 0.3010 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 1.6420 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 2.2070 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 1.3520 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 0.0640 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -0.4360 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.5380 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -0.2460 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -1.6510 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.2060 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -1.4080 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -0.0240 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 -0.8120 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 3.3650 -0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -1.5750 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -1.9230 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 3.7110 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 -0.3620 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 -1.1840 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 -2.4590 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 -2.9100 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -2.0970 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1690 -3.2660 0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 -4.5640 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 1.8140 -0.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9300 2.1340 -1.3830 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7870 3.0240 -1.8800 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4860 2.2170 -1.8820 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6470 1.0600 -2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6700 0.1660 -2.2610 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0190 0.8910 -2.2740 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7320 -1.0430 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0350 0.0180 -1.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1620 2.8570 -1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 3.4730 -3.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 2.4590 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -2.2110 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -3.2290 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -2.6280 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -0.9980 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -1.2180 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -1.8140 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -1.3470 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -2.9750 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 4.3400 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 0.6290 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 -0.8370 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -3.9010 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 -2.4490 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 -5.1140 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 -4.4630 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0300 -5.1030 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 1.8320 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 3.8840 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 2.8330 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -0.1680 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2620 1.1900 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 -0.7080 -4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5130 -1.7240 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -1.5580 -3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -0.7910 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 3.6610 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4370 4.1160 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 38 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 16 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 15 20 1 0 0 0 0 15 24 2 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 36 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 37 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 58 1 0 0 0 0 33 35 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 M END > 593 $$$$ 594 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 0.0690 1.3240 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 2.0150 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.0440 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.7480 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -2.0860 -0.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.7700 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.0740 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 1.3110 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 1.9710 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.8040 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -0.9130 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.0520 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -2.1840 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -1.1770 -3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -0.0360 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 0.0960 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -0.0560 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 1.3310 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 2.0450 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 1.3920 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2980 0.0220 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 -0.7060 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 3.4580 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 4.2090 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 5.6940 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 6.4440 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 6.6020 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 7.2900 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 7.8220 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 7.6650 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 6.9800 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 1.2170 -1.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 2.0010 0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 4.0530 0.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -1.9520 -0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.6130 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -1.7580 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -0.2030 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.8390 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -3.0740 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -1.2830 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 0.7500 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 3.1130 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 1.9550 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2540 -0.4750 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 -1.7730 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 4.0910 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 3.8130 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 5.8120 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 6.0900 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 6.1860 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 7.4130 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 8.3590 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 8.0800 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 6.8580 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 1.1920 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 2.0590 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 33 1 0 0 0 0 2 8 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 5 36 1 0 0 0 0 6 11 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 18 1 0 0 0 0 10 17 1 0 0 0 0 10 35 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 34 2 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 M END > 594 $$$$ 595 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.0010 0.5910 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -0.7740 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -1.2520 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 1.4910 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.0260 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -0.3550 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -0.8070 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 0.0530 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 1.4430 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 1.9590 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -0.3860 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 3.2970 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -2.5910 -0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -3.4490 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 2.3690 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 2.5700 1.5580 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5760 3.4030 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 4.8340 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 3.2390 2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 2.8840 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 3.8710 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 0.9500 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -1.4690 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 2.5530 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -1.7610 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -3.2520 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -4.4890 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -3.2590 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 1.9330 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 3.3310 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 1.6000 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 5.4880 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 5.1050 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 4.9440 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 4.0760 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 1.8580 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 3.4810 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 4.9300 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 3.7590 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 3.3630 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 3 6 2 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END > 595 $$$$ 596 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.2460 1.2000 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.1500 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 1.7560 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 0.9850 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.6170 -0.1830 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0530 0.7500 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 1.6650 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -0.3560 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -0.9290 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -2.6280 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -1.2120 -0.7400 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1540 -3.2010 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -2.3710 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -2.8950 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -4.2420 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -5.0680 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -4.5450 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 1.9720 0.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -0.7050 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -1.1420 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -1.4470 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -1.2590 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -5.3550 -0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -4.7580 -1.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -6.3890 -1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -3.8530 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -5.9980 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -6.7610 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 2.8030 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 1.1230 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 0.7460 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 2.5370 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.9970 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -3.2590 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -2.6020 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -2.2530 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 2.0010 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -1.8630 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -0.2850 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -1.6090 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 -1.5340 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.9830 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -2.4380 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -3.4150 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -3.0630 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -4.3920 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -6.6280 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -6.6120 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -5.2440 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -6.4760 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -7.8390 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -6.2520 -3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 18 1 0 0 0 0 2 9 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 23 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 23 27 1 0 0 0 0 24 26 1 0 0 0 0 25 28 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END > 596 $$$$ 597 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.0370 0.6430 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.7120 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -1.2060 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.5180 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 1.0360 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.3350 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -0.8040 -0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 0.0310 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 1.4100 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 1.9420 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 -0.4220 -0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 3.2690 0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -2.2340 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -2.5360 -0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -3.3660 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 2.3070 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 2.3020 1.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7380 3.1030 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 4.5850 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 2.8820 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8530 2.5100 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 4.0090 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 1.0150 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -1.3870 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 2.5720 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -2.5590 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -2.4160 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -2.7940 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -4.4010 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -3.2900 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.0400 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 1.9440 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 3.3230 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 1.2760 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 5.1220 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 4.8930 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9580 4.8110 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 3.8190 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 3.0840 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8630 1.4480 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 3.8510 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 3.6700 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 5.0700 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 6 2 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 12 22 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END > 597 $$$$ 598 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 90 91 0 0 1 0 0 0 0 0999 V2000 0.0570 0.6370 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.7150 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -1.2020 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 1.5150 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 1.0410 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -0.3280 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -0.7890 -0.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 0.0500 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 1.4260 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 1.9500 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 -0.3980 -0.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 3.2760 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -2.5300 -0.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -3.3650 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 2.3280 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 2.3130 1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7410 3.1230 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7160 4.6080 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 2.8850 2.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 2.5380 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 4.0210 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -2.2170 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 2.4280 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 1.5780 3.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 2.9760 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 2.2910 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 2.8470 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 2.1630 8.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 2.7190 9.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 2.0340 10.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 2.5900 11.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.9060 12.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 2.4620 13.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 1.7770 15.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 2.3330 16.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.6480 17.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 2.2040 18.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 1.5200 19.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 2.0760 20.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.0030 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -1.3940 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 2.5670 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -4.3970 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.3000 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -3.0350 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 1.9740 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7490 3.3440 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 1.2850 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7050 4.9120 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 5.1390 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 4.8470 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 1.4740 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7660 3.1190 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 3.6790 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 5.0800 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 3.8740 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -2.5360 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 -2.3920 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -2.7850 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 4.0500 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 2.7860 4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 1.2180 5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 2.4810 6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 3.9210 6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.6570 6.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 1.0890 8.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 2.3530 8.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 3.7930 9.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 2.5290 8.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 0.9600 10.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 2.2240 10.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 3.6640 11.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 2.4000 10.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 0.8320 12.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 2.0960 13.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 3.5360 13.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.2720 13.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.7030 14.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 1.9670 15.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 3.4070 16.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 2.1430 15.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 0.5750 17.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 1.8390 17.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 3.2780 18.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 2.0140 17.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 0.4460 19.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.7100 20.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 1.5880 21.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 3.1500 20.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.8860 20.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 3 6 2 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 23 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 25 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0 0 105244 1 0 0 0 0 106107 1 0 0 0 0 106112 1 0 0 0 0 106245 1 0 0 0 0 107108 1 0 0 0 0 107109 1 0 0 0 0 107246 1 0 0 0 0 108111 1 0 0 0 0 108247 1 0 0 0 0 109248 1 0 0 0 0 110249 1 0 0 0 0 110250 1 0 0 0 0 110251 1 0 0 0 0 111252 1 0 0 0 0 112253 1 0 0 0 0 113117 1 0 0 0 0 114115 1 0 0 0 0 114119 1 0 0 0 0 114254 1 0 0 0 0 115116 1 0 0 0 0 116117 1 0 0 0 0 116130 1 0 0 0 0 116255 1 0 0 0 0 117118 1 0 0 0 0 117256 1 0 0 0 0 118119 1 0 0 0 0 118120 1 0 0 0 0 118257 1 0 0 0 0 119121 1 0 0 0 0 119258 1 0 0 0 0 120122 1 0 0 0 0 121259 1 0 0 0 0 122123 1 0 0 0 0 122127 1 0 0 0 0 122260 1 0 0 0 0 123124 1 0 0 0 0 124125 1 0 0 0 0 124261 1 0 0 0 0 124262 1 0 0 0 0 125126 1 0 0 0 0 125129 1 0 0 0 0 125263 1 0 0 0 0 126127 1 0 0 0 0 126128 1 0 0 0 0 126264 1 0 0 0 0 127142 1 0 0 0 0 127265 1 0 0 0 0 130266 1 0 0 0 0 130267 1 0 0 0 0 130268 1 0 0 0 0 131132 1 0 0 0 0 131136 1 0 0 0 0 131142 1 0 0 0 0 131269 1 0 0 0 0 132133 1 0 0 0 0 133134 1 0 0 0 0 133139 1 0 0 0 0 133270 1 0 0 0 0 134135 1 0 0 0 0 134141 1 0 0 0 0 134271 1 0 0 0 0 135136 1 0 0 0 0 135138 1 0 0 0 0 135272 1 0 0 0 0 136137 1 0 0 0 0 136273 1 0 0 0 0 137274 1 0 0 0 0 138275 1 0 0 0 0 139140 1 0 0 0 0 139276 1 0 0 0 0 139277 1 0 0 0 0 140278 1 0 0 0 0 141279 1 0 0 0 0 M END > 599 $$$$ 600 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0590 1.4820 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.1640 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -0.5560 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 2.2330 -0.3980 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3910 1.3330 -0.8000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4550 0.0590 0.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3110 -0.9090 -0.7900 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1400 -0.4600 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.7830 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 2.1800 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 3.4820 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 2.8100 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 2.0990 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 0.3280 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -0.8140 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -1.7210 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 0.7760 1.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 0.1420 2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 1.0140 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.3450 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 3.0510 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -1.9320 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -0.1980 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -1.2560 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 0.4950 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 1.5170 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 1.6440 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 3.9980 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 4.0180 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 2.0090 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 3.2790 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 3.5540 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 2.3090 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 1.4980 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 3.0370 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -1.1980 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 -1.4030 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 0.2280 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 0.0850 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 1.3720 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 1.7630 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 6 1 0 0 0 0 3 16 2 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 M END > 600 $$$$ 601 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 1.2180 2.0780 -0.3900 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7730 0.6080 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 0.0060 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 2.0770 0.1690 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6320 1.6670 1.6230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2430 1.0390 1.9340 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4320 0.3860 3.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9340 0.0010 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 0.5330 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 3.4810 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 2.8920 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 1.3730 4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.1780 1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 2.7360 0.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.7640 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 3.8100 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 2.1560 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 2.5040 2.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.5560 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 0.0900 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 1.3740 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.5050 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 0.4700 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -1.0820 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -0.2460 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 0.9150 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 4.1860 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 3.4810 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 3.7750 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 3.5510 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.5700 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 3.4250 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.5450 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 0.9600 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 2.3160 4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 2.3940 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 4.1810 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 4.3020 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 6 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 M END > 601 $$$$ 602 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.2880 1.2760 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 2.1160 0.0850 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9870 3.5590 0.0930 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4910 3.4300 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 2.1350 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 1.0720 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.3280 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -1.1090 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -0.5800 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 1.7420 1.4170 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3410 0.8420 1.0540 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8550 1.4630 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 1.9300 -0.9970 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2640 0.0650 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 4.4580 -0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 4.1310 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 4.3280 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.7890 2.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -2.4240 1.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -1.3860 0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -1.6500 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -3.2870 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 1.0590 2.1380 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.8020 2.9680 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 2.4920 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 0.6770 -2.1820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 4.0130 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 1.7900 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 1.0410 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.6550 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 0.7160 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 2.3130 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 2.8750 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 5.0480 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 3.4860 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 3.6140 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 5.2500 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 -0.7300 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -2.3960 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -2.0230 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -4.3170 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.0010 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -3.2020 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 0.8290 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 3.2880 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 3.7830 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 3.0640 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 2.6110 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 14 2 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 26 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 25 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M END > 602 $$$$ 603 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.2030 1.3120 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -0.1930 0.2580 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3030 -0.5650 0.2990 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0200 0.7630 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.7620 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 0.2890 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 1.3920 -1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 1.1380 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -0.0450 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.7080 -1.0060 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2650 -1.1640 -0.5670 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0240 -1.7200 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.8070 1.4500 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1950 2.0130 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 0.9210 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 2.2810 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -1.3660 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 2.5100 -2.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 2.1100 -1.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -0.2260 0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 0.9050 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 2.5180 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -2.2440 -1.4820 N 0 0 3 0 0 0 0 0 0 0 0 0 -0.2160 -2.0380 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.8160 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 0.4940 2.4460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -3.2760 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -1.0910 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.8050 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.2260 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 0.7220 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -1.6570 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -2.7510 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -1.3940 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 2.2660 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 2.8410 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 2.7580 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -1.6310 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6330 1.1900 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 0.6520 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 1.7380 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 3.2290 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 2.9900 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 1.6460 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -1.8570 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -2.5770 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -3.8720 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -2.6970 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -2.8310 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -4.0660 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -3.6960 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 14 2 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 26 1 0 0 0 0 13 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END > 603 $$$$ 604 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.2010 1.3150 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -0.1890 0.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3040 -0.5630 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 0.7660 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 1.7650 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.2990 -2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 1.4040 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 1.1520 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -0.0320 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.7060 -1.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2660 -1.1490 -0.5720 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0290 -1.7110 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.8020 1.4440 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1930 2.0170 0.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 0.9220 0.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 2.2830 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 2.5240 -2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 2.1250 -1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -0.2140 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 0.9170 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 2.5340 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.2280 -1.5010 N 0 0 3 0 0 0 0 0 0 0 0 0 -0.2020 -2.0250 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -2.9820 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 0.4990 2.4430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -3.1000 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -1.1730 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -1.0890 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 2.8080 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -0.2110 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.7280 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -1.6440 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -2.7430 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.3940 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 2.2670 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 2.8420 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 2.7600 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 1.2030 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 0.6630 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 1.7500 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 3.2450 -2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 3.0060 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 1.6640 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -1.8610 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -2.4290 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -3.8440 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -3.3100 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -2.5130 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -3.8900 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -3.5430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 14 2 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 17 2 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 25 1 0 0 0 0 13 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END > 604 $$$$ 605 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 0.0840 1.0950 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -0.3960 -0.4760 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2900 -0.6500 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 1.8810 -0.1260 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3290 1.7010 -1.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5290 0.1960 -1.5240 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5590 -0.0360 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 0.4630 -2.2370 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6900 2.3150 -1.0170 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8270 1.9520 -1.9630 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7390 2.7180 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 4.1400 -2.8090 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9440 4.6600 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.8140 -0.7550 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3010 3.8540 -1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 2.4910 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 4.6810 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 1.9060 -0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 4.1210 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 5.1790 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 5.8280 0.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 5.5570 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 2.3720 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.8960 0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -2.1390 -1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.4510 -2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -0.1540 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -0.5570 -3.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -0.2270 -1.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 -1.3690 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 -2.1410 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -1.7770 -2.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 1.8580 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 3.2770 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 3.7110 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 5.1460 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 2.9500 2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.4710 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.2540 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.9240 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 1.5380 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 0.2940 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 2.3400 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 2.6930 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 4.8040 -3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 5.6900 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 4.6850 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 4.1330 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 5.6610 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 4.3690 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0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 2 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 19 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 2 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 M END > 605 $$$$ 606 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 -0.1020 0.9480 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.5470 -0.3520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0870 -0.8480 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 1.7140 -0.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0830 1.5330 -1.3480 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3210 0.0290 -1.4990 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2670 -0.2620 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 0.2740 -2.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4310 2.2240 -1.1400 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5480 1.7760 -2.0660 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4480 2.4510 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 3.9070 -3.0800 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6170 4.4790 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 3.7390 -1.0510 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5320 -2.3210 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -1.0250 0.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 3.1040 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.1410 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -0.2720 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -0.7640 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 1.8960 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 5.3540 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 5.9200 0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 5.9170 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 4.2240 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 3.4850 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 2.6810 2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 4.9160 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -0.3520 -1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 -1.4880 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 -2.1960 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 -1.9420 -2.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 2.3310 -1.5460 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9800 3.7460 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 4.6540 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 2.3020 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.3060 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.1340 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 5.5310 6.6040 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 6.4510 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 5.1040 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 5.4880 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 4.9510 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 5.3460 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -2.9120 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 -2.7220 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 -1.4670 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7070 1.7260 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 5.6310 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 4.4260 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 2.6410 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 25 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 17 26 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 33 34 1 0 0 0 0 33 36 1 0 0 0 0 33 69 1 0 0 0 0 34 35 2 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 36 72 1 0 0 0 0 M END > 606 $$$$ 607 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 70 73 0 0 1 0 0 0 0 0999 V2000 0.0460 1.0820 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -0.4110 -0.4530 C 0 0 1 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 5.3880 5.6910 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 4.1730 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 3.6210 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 2.8200 2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 5.0550 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.2580 -1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 -1.4020 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -2.1500 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 -1.8320 -2.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 2.4470 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 3.7930 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 4.6240 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 1.8770 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.4660 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.2490 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.9270 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 1.4460 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.1630 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 0.4280 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 0.2020 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 2.2110 -4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.6020 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 4.6850 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 5.6580 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 4.6150 -2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 4.1600 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.8060 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -2.4340 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -2.3250 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.8060 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 3.4130 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 2.0940 -3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.9630 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.4250 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.6200 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.3370 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 4.9950 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 6.6930 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 5.6920 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 5.3160 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 5.1790 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 5.7070 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -1.6130 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -3.1480 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4640 -2.2290 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 5.5900 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 4.3300 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 25 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 17 26 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 33 34 1 0 0 0 0 33 36 2 0 0 0 0 34 35 2 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 M END > 607 $$$$ 608 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 77 80 0 0 1 0 0 0 0 0999 V2000 0.0210 1.0520 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.4420 -0.4400 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2070 -0.7260 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 1.8100 -0.1200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2390 1.6320 -1.3530 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4530 0.1290 -1.5460 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4120 -0.1460 -2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 0.3580 -2.2700 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5980 2.2740 -1.0950 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7160 1.8540 -2.0400 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6270 2.5800 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 4.0180 -2.9720 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8480 4.5780 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 3.7820 -0.9130 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2110 3.7860 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 2.3910 -1.4560 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2120 -0.3090 -1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 1.8730 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -0.2070 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.9430 0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 4.1540 0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 3.2040 0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -2.2120 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.5870 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -1.4530 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -1.8830 -2.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 -2.2030 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 5.2530 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 3.5990 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 5.0340 1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 2.8040 2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 5.8840 0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 5.7000 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 2.2880 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 4.6260 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 1.5420 -1.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 1.4440 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 0.5810 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 2.0470 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4300 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.2250 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.9620 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 1.4230 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -1.2070 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 0.3840 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 0.1510 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 2.1710 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 2.5500 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 4.6420 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 5.6180 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 4.5790 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 4.1150 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 2.4210 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -0.8180 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -2.8440 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -2.4780 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -2.3610 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.3830 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.6660 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -1.3790 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -2.9140 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2830 -2.7390 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -1.4970 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 5.1510 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 5.3070 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 5.6810 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 5.9070 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 6.6030 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 4.9120 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 3.3690 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 2.0440 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 1.9190 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 5.5950 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 4.3500 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 0.9430 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 0.6260 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -0.4490 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 42 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 21 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 35 2 0 0 0 0 16 36 1 0 0 0 0 16 53 1 0 0 0 0 17 25 1 0 0 0 0 20 54 1 0 0 0 0 21 28 1 0 0 0 0 22 29 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 28 32 2 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 70 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 35 74 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 M END > 608 $$$$ 609 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 0.0110 1.0360 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -0.4580 -0.4350 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2020 -0.7460 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 1.7920 -0.1210 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2230 1.6190 -1.3620 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4450 0.1150 -1.5420 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4060 -0.1630 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 0.3550 -2.2640 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5750 2.2770 -1.1150 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6970 1.8530 -2.0530 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6020 2.5600 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 4.0050 -3.0150 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8090 4.5680 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 3.7890 -0.9570 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1790 3.7940 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 2.4070 -1.4760 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2020 -0.2950 -1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 1.8970 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -0.2100 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -0.9670 0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 4.1790 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 3.1630 0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -2.2280 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.6240 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.4370 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 -1.8790 -2.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 -2.1690 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 2.2610 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 4.6440 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 1.5730 -1.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -1.4040 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -1.9460 3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -1.3630 1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.4130 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.2110 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -0.9760 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 1.3960 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -1.2260 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 0.3560 -3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 0.1420 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 2.1440 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 2.5200 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 4.6190 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 5.6140 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 4.5500 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 4.1180 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 2.4500 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 5.1330 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 3.3160 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.8650 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -2.4980 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -2.3660 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 0.3420 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -0.7050 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -1.4220 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -2.8800 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 -2.7030 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5350 -1.4530 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 3.3430 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 2.0190 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 1.8810 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 5.6060 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9330 4.3820 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 1.8630 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -1.1330 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -2.6980 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.3980 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 29 2 0 0 0 0 16 30 1 0 0 0 0 16 47 1 0 0 0 0 17 25 1 0 0 0 0 20 31 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 M END > 609 $$$$ 610 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 0.0590 1.1060 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.3880 -0.4580 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2500 -0.6600 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 1.8610 -0.1100 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2880 1.6920 -1.3360 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4980 0.1900 -1.5450 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4670 -0.0730 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.4220 -2.2460 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6470 2.3180 -1.0520 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7700 1.9150 -1.9990 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6790 2.6580 -3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 4.0820 -2.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9240 4.6380 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 3.8200 -0.8280 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2730 3.7940 -1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 2.4430 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.2630 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 1.8870 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -0.1580 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -0.9080 0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 4.1370 0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 3.2360 0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.1490 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.5000 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -1.4080 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -1.8230 -2.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 -2.1760 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 2.3670 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 4.6090 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 1.8580 -0.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -1.3550 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.9100 2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -1.3120 1.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 1.4920 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.2710 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -0.9040 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 1.4770 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -1.1340 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 0.4650 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 0.2240 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 2.2540 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 2.6470 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 4.7240 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 5.6710 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 4.6550 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 4.1590 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 5.0810 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 3.3960 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -2.7760 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -2.4060 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -2.3110 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.4730 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.5740 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.2870 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -1.6520 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -3.1730 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4730 -2.2600 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 3.4470 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 2.1280 -3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 2.0100 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 5.5800 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 4.2970 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.8670 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -1.3180 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -2.9450 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 29 2 0 0 0 0 16 30 2 0 0 0 0 17 25 1 0 0 0 0 20 31 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END > 610 $$$$ 611 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 0.0460 1.0850 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -0.4080 -0.4520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2370 -0.6850 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 1.8410 -0.1130 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2690 1.6710 -1.3430 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4830 0.1680 -1.5430 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4530 -0.0980 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 0.4020 -2.2460 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6270 2.3070 -1.0670 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7510 1.8970 -2.0090 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6590 2.6270 -3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 4.0560 -2.9200 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8980 4.6170 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 3.8110 -0.8610 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2480 3.7810 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 2.4340 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.2730 -1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 1.8880 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -0.1720 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -0.9180 0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 4.1500 0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 3.2150 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -2.1720 -1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.5350 -2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -1.4180 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 -1.8400 -2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -2.1760 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 5.2360 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 5.8850 0.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 5.6480 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.3380 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 4.6030 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 1.8580 -0.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.4680 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.2530 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -0.9250 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 1.4550 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -1.1600 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.4340 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 0.2010 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 2.2190 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 2.6100 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 4.6910 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 5.6530 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 4.6270 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 4.1490 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.8000 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 3.3730 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -2.8030 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -2.4320 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -2.3280 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.4370 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -0.6100 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.3240 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 -2.8880 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -2.7120 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 -1.4760 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 5.8520 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 6.5460 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 4.8440 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 3.4180 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 2.0980 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 1.9740 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3140 5.5710 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 4.3000 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 32 2 0 0 0 0 16 33 2 0 0 0 0 17 25 1 0 0 0 0 20 47 1 0 0 0 0 21 28 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END > 611 $$$$ 612 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 0.0170 1.0460 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.4490 -0.4370 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2070 -0.7340 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 1.8020 -0.1200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2310 1.6290 -1.3570 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4500 0.1250 -1.5420 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4120 -0.1510 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.3600 -2.2600 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5860 2.2810 -1.1040 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7080 1.8580 -2.0430 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6170 2.5730 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 4.0140 -2.9920 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8290 4.5760 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 3.7910 -0.9360 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1970 3.7940 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 2.4040 -1.4620 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2050 -0.2960 -1.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 1.8920 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -0.2040 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.9500 0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 4.1700 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 3.1960 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -2.2180 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.6050 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -1.4400 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -1.8780 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -2.1790 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 2.2770 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 4.6390 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 1.5690 -1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 3.5840 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 5.0180 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 2.7840 2.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.4220 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 1.2200 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -0.9660 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 1.4110 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -1.2140 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 0.3720 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 0.1490 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 2.1590 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 2.5380 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 4.6320 -3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 5.6200 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 4.5650 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 4.1230 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 2.4420 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -0.8270 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 5.1230 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.8520 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -2.4850 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -2.3590 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.3630 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.6850 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -1.4010 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -1.6360 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -3.1780 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -2.2570 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 3.3590 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 2.0350 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 1.9020 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 5.6030 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 4.3700 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 1.8550 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 5.5850 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 5.0570 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 5.4490 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 29 2 0 0 0 0 16 30 1 0 0 0 0 16 47 1 0 0 0 0 17 25 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 31 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 M END > 612 $$$$ 613 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 -0.0300 1.1230 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -0.3670 -0.4870 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3020 -0.6650 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.8750 -0.0790 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2600 1.7140 -1.2410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5260 0.2090 -1.4130 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5710 -0.0080 -2.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9120 0.5270 -1.9630 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5730 2.4000 -0.8890 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7720 2.0200 -1.7470 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7560 2.7350 -3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 4.1790 -2.6550 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8520 4.7100 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 3.9070 -0.7070 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2080 3.9450 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 2.5970 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -0.1340 -0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 2.0080 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -0.1050 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.8720 0.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 4.2840 0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 3.2410 0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -2.1430 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.5970 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -1.2620 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 -1.6820 -1.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 -2.0050 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 2.3400 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1790 4.8010 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 2.0480 -0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -1.3160 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -1.8540 2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.2840 1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -1.3750 -2.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.4960 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.2980 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.8930 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.4680 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 0.5530 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 0.3380 -2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 2.3400 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 2.6860 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 4.8140 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 5.7560 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 4.6860 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 4.2240 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 5.2350 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 3.3820 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -2.7510 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -2.5050 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -2.2120 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.3450 -3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -0.6590 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.4280 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -2.7340 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 -2.5200 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -1.2980 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 3.4220 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 2.0980 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 1.9480 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 5.7670 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9120 4.5270 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -1.8030 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -1.2570 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.8900 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -1.5180 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 37 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 21 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 29 2 0 0 0 0 16 30 2 0 0 0 0 17 25 1 0 0 0 0 20 31 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 613 $$$$ 614 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 74 0 0 1 0 0 0 0 0999 V2000 0.0420 1.0400 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -0.4530 -0.4510 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2410 -0.7210 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 1.8250 -0.1350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2780 1.6370 -1.3390 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4780 0.1290 -1.5200 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5010 -0.1180 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 0.3830 -2.2450 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6390 2.2640 -1.0560 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7750 1.8770 -1.9940 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6960 2.6260 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 4.0600 -2.8820 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8810 4.5910 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 3.7690 -0.8340 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2500 3.8260 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 2.4200 -1.3860 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3630 -0.2840 -1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 1.8360 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -0.2060 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -0.9420 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 4.1190 0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -2.2080 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.5430 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -1.4320 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 -1.8640 -2.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -2.1810 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 2.2890 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 4.6710 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -0.6510 -3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 1.6050 -1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 5.1990 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 5.6230 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 5.8300 0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 3.2220 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 3.6580 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 5.0930 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 2.8980 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.4060 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.2090 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -0.9820 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 1.4850 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 0.1970 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 2.2380 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 2.5900 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 4.7050 -3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 5.6290 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 4.5940 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 4.0890 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 2.4270 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -0.8190 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.8390 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -2.4500 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -2.3810 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.4310 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -0.6030 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -1.3280 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -2.4580 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -3.0810 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 -1.5460 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 3.3720 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 2.0270 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.9350 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 5.6470 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 4.3910 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 1.8890 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 4.9380 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 6.6330 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 5.6050 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 5.6200 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 5.1280 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 5.5700 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 29 2 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 21 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 28 2 0 0 0 0 16 30 1 0 0 0 0 16 49 1 0 0 0 0 17 24 1 0 0 0 0 20 50 1 0 0 0 0 21 31 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 M END > 614 $$$$ 615 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 71 74 0 0 1 0 0 0 0 0999 V2000 0.0860 1.1380 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.3550 -0.4540 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2710 -0.6170 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.9200 -0.1200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3540 1.7120 -1.2930 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5240 0.2060 -1.5140 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5340 -0.0190 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 0.4420 -2.2550 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7300 2.2750 -0.9530 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8630 1.9190 -1.9070 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8290 2.7650 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 4.1520 -2.6260 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0470 4.6580 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 3.7570 -0.6160 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3910 3.8160 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 2.3770 -1.2480 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4160 -0.2990 -1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 1.7630 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -0.1660 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -0.8430 0.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 4.0010 0.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -2.1130 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -0.3850 -2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 2.4110 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3730 4.6120 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -0.5100 -3.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 1.5550 -1.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 5.0270 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 5.3400 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 5.6990 1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 3.3230 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 3.7980 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 5.2400 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 3.0710 2.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 1.3590 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 0.5170 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3060 1.8570 0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.5120 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.3080 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.8840 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 1.6100 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 0.2970 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 2.4100 -3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 2.7890 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 4.8500 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 5.6670 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 4.7260 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 4.0740 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 2.3030 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -1.2540 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -0.7180 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -2.7240 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.3490 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -2.3220 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.6030 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -0.4490 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -1.1450 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 3.4900 -2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 2.1450 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 2.0970 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 5.6190 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 4.2600 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 6.0450 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 5.7790 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 4.4220 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 5.7350 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 5.2890 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 5.7400 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 0.1560 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3970 1.1180 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5960 -0.3320 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 26 2 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 21 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 25 2 0 0 0 0 16 27 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 20 51 1 0 0 0 0 21 28 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 M END > 615 $$$$ 616 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.0680 1.0700 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.4360 -0.2870 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9930 -0.7670 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.8030 -0.0940 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1610 1.5340 -1.3080 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2770 0.0230 -1.5090 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1550 -0.2160 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 0.2890 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1220 -1.0840 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6730 1.3560 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 1.8470 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 3.3210 -1.8860 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0790 4.0950 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 3.5740 -1.5360 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7310 2.0960 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 -0.3490 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.8890 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 4.4340 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -2.2710 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -0.5670 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 2.1920 -2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -0.7500 -3.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 3.1980 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 3.8760 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 3.8740 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2940 4.4480 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 4.3610 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -1.2630 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -1.7450 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -1.2120 1.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.4220 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.2940 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -0.9500 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.4650 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 -0.1940 -2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 1.7470 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 1.2660 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 3.4080 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 3.9600 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 5.1540 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 3.6390 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 5.3580 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -2.8580 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -2.5570 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -2.4580 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 0.4300 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.6740 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -1.3140 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 3.2750 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 1.9080 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 1.8630 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 3.4190 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 4.4600 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 2.8490 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6600 4.4780 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2600 4.7590 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9500 4.3630 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -1.7210 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -1.0970 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.7660 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 8 10 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 18 1 0 0 0 0 14 41 1 0 0 0 0 17 28 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 M END > 616 $$$$ 617 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 15 16 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3160 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -0.6950 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 2.0200 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.3260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -0.0780 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -0.4890 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 0.6300 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 1.6940 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 3.4040 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -0.5370 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -1.4060 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 0.6330 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 3.8710 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 3.9060 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 6 2 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 M END > 617 $$$$ 618 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 32 34 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3680 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.6220 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -2.2260 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.9550 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -1.7430 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -2.1660 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.3730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 1.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 0.7710 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 2.2180 0.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4910 3.7620 1.3540 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7200 2.4250 1.4690 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8840 3.5560 -0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 4.4240 0.0880 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8910 3.5200 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 1.3630 1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 5.7880 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 6.4370 -0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -2.9740 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -3.1150 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -1.5150 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.8280 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 1.7910 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 4.3860 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 2.5150 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 4.5410 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 4.3240 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 1.4920 2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 6.4010 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 5.6520 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 7.3090 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 3 2 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 13 17 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 M END > 618 $$$$ 619 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 70 74 0 0 1 0 0 0 0 0999 V2000 -0.0060 1.5320 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0050 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.5180 -1.2820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4350 2.0460 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 1.5810 -1.2750 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0590 0.0590 -1.4290 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7430 -0.3440 -2.7360 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3080 0.9020 -3.4260 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6500 1.8730 -1.1520 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2740 1.6640 -2.5380 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5390 3.0710 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 3.4520 -2.3380 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4620 3.5610 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 3.2500 -0.6110 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2400 -0.2400 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 2.2830 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.3750 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.0510 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 5.3520 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 5.3780 0.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 6.4950 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 4.3060 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 0.5380 -4.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 1.0350 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6470 2.1590 -2.5860 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8380 2.0220 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -0.1180 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 1.1160 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6020 0.8720 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7520 0.6520 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.7770 -3.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -1.0110 -2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -0.8790 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -0.1440 -4.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -1.6480 -3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -1.2790 -2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.9120 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.8840 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.3550 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.3710 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 3.1370 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 1.6700 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -0.8240 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 2.9840 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 3.7580 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 4.3430 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 2.8980 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 4.5900 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 3.2180 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 0.8220 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.5250 -3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 2.1740 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 3.3580 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -2.4840 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.4670 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -2.2840 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 6.2960 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 6.6000 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 7.4170 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 0.1070 -5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 2.1480 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4620 2.9130 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 1.9110 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2770 -0.2390 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4160 1.5140 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 0.5120 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -1.0560 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -1.8590 -4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -2.5860 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -1.5760 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 22 1 0 0 0 0 14 49 1 0 0 0 0 15 32 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 31 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 26 29 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 29 30 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 M END > 619 $$$$ 620 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.5300 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.0040 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.5050 -1.2870 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4360 2.0470 -0.0120 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1490 1.6020 -1.2810 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0530 0.0800 -1.4440 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7060 -0.3250 -2.7660 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2940 0.9150 -3.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6520 1.9010 -1.1780 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2830 1.6360 -2.5490 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6540 3.0050 -3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 3.3390 -2.3290 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4880 3.5630 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 3.2970 -0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2540 -0.2280 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 2.3030 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -0.3610 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -2.0390 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 4.3360 -1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 0.5520 -4.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 0.9480 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 1.9990 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 1.8200 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 -0.2420 -2.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 1.1720 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 1.8220 -3.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -1.0110 -2.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -0.8820 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -0.1380 -4.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -1.6630 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -1.2960 -2.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 3.4740 0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.9130 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.8850 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.3600 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.3710 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 1.6560 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -0.7750 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 2.8630 -4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 3.7360 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 4.1560 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 2.8890 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 4.5930 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 3.3320 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 0.8320 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -0.5030 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 2.1700 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 3.3820 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -2.4790 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -2.4470 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.2740 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 5.2210 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 0.1400 -5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6290 2.6740 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 0.8210 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -1.0810 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -1.8710 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.6030 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -1.5970 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 3.8060 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 38 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 19 1 0 0 0 0 14 44 1 0 0 0 0 15 27 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 26 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 2 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 M END > 620 $$$$ 621 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 69 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.5320 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0060 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.5180 -1.2800 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4350 2.0480 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.5840 -1.2770 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0620 0.0610 -1.4250 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7490 -0.3450 -2.7300 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3050 0.9000 -3.4270 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6480 1.8860 -1.1590 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2700 1.6710 -2.5460 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5280 3.0750 -3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 3.4670 -2.3600 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4510 3.5850 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 3.2680 -0.6300 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2330 -0.2440 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 2.2800 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -0.3690 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.0510 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.3000 -1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 0.5350 -4.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 1.0490 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 2.1760 -2.6000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8320 2.0500 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -0.1010 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.1360 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 1.7690 -3.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -1.0180 -2.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -0.8900 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.1550 -4.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -1.6630 -3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -1.2710 -2.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 0.9010 -2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7520 0.6900 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 2.1600 -3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.9130 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.8840 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.3550 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.3700 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 3.1380 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 1.6690 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -0.8340 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 2.9810 -4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 3.7610 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 4.3580 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 2.9290 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 4.6180 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 3.2460 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.8170 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -0.5290 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 2.1700 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 3.3550 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.4850 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.4670 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -2.2810 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 5.1780 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 0.0980 -5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 2.9430 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 1.9450 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.2660 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -0.9670 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -2.3130 -4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -1.5700 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4130 1.5540 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 0.5570 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2810 -0.2010 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 41 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 19 1 0 0 0 0 14 47 1 0 0 0 0 15 27 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 26 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 32 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 M END > 621 $$$$ 622 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 0.0720 1.4280 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.0780 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -0.7350 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.6950 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -1.0920 -4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -2.2110 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -2.6810 -4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -1.6150 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -2.0590 -1.9550 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6280 -3.0740 -2.7480 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8670 -3.4430 -1.9310 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8430 -2.6990 -0.5930 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3510 -2.8200 -0.6970 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5820 -2.9750 0.2040 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4420 -1.9360 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -2.6680 2.2380 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0800 -2.7440 1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -2.1790 0.0440 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4600 -3.9290 -4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -0.8620 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -4.0030 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -1.6010 -4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -3.0320 0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -4.3200 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -4.0650 2.3050 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1190 -5.1550 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -5.3960 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -3.8300 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.2890 -0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -4.8560 -1.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -6.3800 2.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -7.4760 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -4.0120 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 1.8040 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.8070 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.7630 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -0.2410 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.7690 -4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -3.0540 -5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -1.8520 -5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.8210 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.4620 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -3.1720 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -1.8410 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -0.9700 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.2070 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -3.7550 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -2.1460 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.4490 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -3.6640 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -4.2970 -4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -4.7050 -4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -0.2550 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -0.2160 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -0.6510 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -1.8810 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -1.5030 -5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 -2.8080 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -4.8690 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -5.2890 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 -5.1590 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -8.3680 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -7.2380 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -7.6580 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 10 1 0 0 0 0 7 19 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 43 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 29 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 31 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 M END > 622 $$$$ 623 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 65 69 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.3530 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 1.0690 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 0.9800 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -0.4040 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 0.8620 -1.9490 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1410 -0.4980 -1.3150 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6290 -0.7150 -1.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8300 -2.1170 -0.4450 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4800 -2.8350 -0.3730 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4600 -0.5890 0.0630 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4700 -2.0740 0.4640 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0430 -2.6090 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.0840 1.4400 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6690 -0.5550 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.0840 0.0750 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0100 -0.3610 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -1.6030 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -0.0070 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -1.4460 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -4.1560 0.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -2.1970 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -2.5700 2.5240 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0550 -1.9200 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -2.0320 2.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -0.0200 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -2.8920 -1.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -2.0190 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -2.4980 4.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -1.9550 6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.9470 -2.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 2.1600 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 2.3260 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 3.1210 -2.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -3.6600 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 1.7430 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 0.3310 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 2.0670 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 1.7410 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 1.1490 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 1.6500 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -2.7030 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -3.7020 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -2.2020 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -2.5020 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.1080 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.1730 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.4360 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -0.1270 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -1.3310 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 0.4050 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -1.4790 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.5370 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -1.3740 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -2.4430 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -1.2660 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -4.7120 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -2.0830 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.8500 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -2.8740 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -2.1190 6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -0.8850 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -2.4460 6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 2.5300 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 3.1560 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 1.4100 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 7 1 0 0 0 0 4 16 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 41 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 26 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 28 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END > 623 $$$$ 624 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5460 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2240 -0.3170 0.9000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3800 1.9020 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.9810 0.8730 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8020 -0.6120 2.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.5340 0.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 2.0590 -1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 0.6880 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 1.8740 0.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 1.9320 -0.0730 P 0 0 3 0 0 0 0 0 0 0 0 0 5.8610 1.6820 -1.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 3.3790 0.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8990 3.9700 0.3400 P 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 5.5790 0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6240 3.4430 1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 3.5190 -0.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 0.8850 0.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 2.7960 -2.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 2.3150 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 2.0390 -0.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 3.0260 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 3.5300 -4.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 2.7470 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 2.2370 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 2.4530 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 2.8540 -3.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.9180 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -1.1470 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.3860 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 1.4010 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.3870 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -1.4950 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.0950 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 0.3580 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 2.3320 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 6.0040 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 3.7020 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 2.1430 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 3.7200 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 3.6940 -4.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 2.4350 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 29 1 0 0 0 0 3 7 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 9 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 25 2 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M END > 624 $$$$ 625 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.8990 0.0100 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -2.4550 0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.5140 1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.6570 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 4.1720 5.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 4.3560 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 3.9300 3.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 3.5400 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 3.0660 4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 3.2870 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 2.7320 2.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 2.2030 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 2.4000 5.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 2.7110 1.5410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1630 3.9730 1.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4090 3.4910 -0.1190 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4180 1.9540 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0700 1.6250 1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 3.9060 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 5.0600 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 3.3520 7.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -3.0540 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -0.8880 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 4.8750 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 1.6950 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 2.6330 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 4.2510 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 3.8670 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.5220 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 4.8650 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 5.8440 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 2.8880 7.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 3.6830 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END > 625 $$$$ 626 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.8990 0.0100 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.9400 -2.4550 0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.5140 1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.6570 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -3.7930 0.4890 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.7340 -4.9440 0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -6.3550 1.7090 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -6.0950 3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -3.5100 1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -4.2900 -0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -7.0950 1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -7.2210 1.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 4.1720 5.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 4.3560 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 3.9300 3.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 3.5400 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 3.0660 4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 3.2870 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 2.7320 2.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 2.2030 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 2.4000 5.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 2.7110 1.5410 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1630 3.9730 1.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4090 3.4910 -0.1190 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4180 1.9540 -0.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0700 1.6250 1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 3.9060 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 5.0600 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 3.3520 7.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -0.8880 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -5.6140 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -4.4940 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -8.0860 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 4.8750 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 1.6950 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 2.6330 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 4.2510 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 3.8670 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.5220 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 4.8650 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 5.8440 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 2.8880 7.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 3.6830 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 35 1 0 0 0 0 12 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 M END > 626 $$$$ 627 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.0490 1.4770 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 2.0840 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.2890 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.1030 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -4.4820 5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -3.8550 5.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -3.1900 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -4.4360 4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -3.7670 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -3.1490 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -2.5230 2.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.6830 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -3.3680 0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -3.6910 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -3.6930 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.6150 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 0.1020 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.6850 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.1860 -0.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7860 1.9190 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 1.1540 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 1.8420 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 3.1280 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 3.4670 0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 4.2960 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 2.0830 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -0.7210 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -5.0110 6.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -3.8860 6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -2.7010 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -4.9270 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -4.6510 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -2.9120 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -4.6840 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -3.6420 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -3.0390 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -1.7740 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -0.3650 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.6480 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 2.5220 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 1.1120 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 2.4100 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 3.8850 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 4.0580 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 5.3490 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 4.0990 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 18 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 10 2 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END > 627 $$$$ 628 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 0.8270 3.4940 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 2.0170 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.1850 1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 2.0170 6.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 1.7130 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.0100 4.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4950 1.4480 5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 1.1490 6.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6580 1.3630 3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 1.7040 3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 1.7710 5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 2.3120 5.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 2.0070 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 3.4060 3.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9280 4.2040 2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 4.7550 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 3.3470 2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.4960 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 1.3450 1.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 1.1320 2.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.3630 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 1.7290 7.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -0.6460 6.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -1.4320 8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -2.1190 8.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -1.6480 8.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 3.8450 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 4.0290 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 3.6760 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 0.1220 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 1.5220 3.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 2.7860 3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -0.0690 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 3.8920 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 3.7180 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 5.2150 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 4.2460 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 4.7130 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 5.1600 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 5.3970 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 2.9420 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5400 2.7050 3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 2.3280 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.9860 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.7960 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 1.6490 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.8030 5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.7960 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 2.6900 7.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -0.2010 6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -1.4430 9.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -3.0160 9.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -2.3960 7.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -1.0740 8.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -2.7080 8.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -1.3200 9.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 5 1 0 0 0 0 3 30 1 0 0 0 0 4 7 2 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 21 23 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 M END > 628 $$$$ 629 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 1.7360 1.0440 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -0.3080 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -0.3880 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 2.1350 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 2.1610 -0.3150 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9320 0.8100 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 0.6480 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 1.7980 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 3.3140 -0.4980 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1890 3.0400 -1.7500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4600 5.7730 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 4.6190 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 5.4400 -2.4480 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0060 4.2110 -2.2540 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6910 3.8700 -3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 5.0320 -4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 6.5710 -2.9380 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7220 6.2730 -4.2350 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5010 7.5980 -4.3870 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5270 8.6820 -3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 7.9100 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -1.7080 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.4060 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 2.3590 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 3.3860 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 2.7500 -2.5500 H 0 0 0 0 0 0 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7.7800 0.8420 3.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9170 -0.3330 2.6260 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1930 -1.6040 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7010 -1.9060 3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 -0.6850 4.1420 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2630 0.4960 3.1780 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0980 1.5500 3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7900 -0.7170 4.5990 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1030 0.7770 4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 1.0170 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -0.6890 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9230 0.2600 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7420 -1.4150 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -0.5070 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 2.3350 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 0.3700 4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7110 -0.4250 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1070 -1.8180 4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -1.6550 2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 1.1450 4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 1.0510 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 0.1180 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 3.9040 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 3.5280 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 2.1510 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 1.5650 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 2.3850 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 3.6710 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -0.3090 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -1.4920 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -1.9000 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -1.4430 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 1.8590 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1570 2.8910 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 3.3230 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 2.7770 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -1.5110 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 -2.4470 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 -2.7830 4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0910 -2.1140 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 2.1840 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 2.1480 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8440 -1.1990 5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1190 0.9860 4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0000 1.0570 5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.0890 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 0.2010 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 1.9530 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0630 0.2140 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 -1.1330 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -1.4020 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5850 1.0180 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0060 0.3220 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 -0.7290 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -0.7110 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.3610 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.3320 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 2.8590 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 1.5520 3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 3.0400 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -0.4540 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 1.2930 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 0.4750 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0580 -2.8240 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8140 -1.8040 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4350 -1.1200 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 33 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 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0 0 1 0 0 0 0 0 0 0 0 0 -4.6270 -2.2590 0.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4350 -2.8260 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.0680 -0.0660 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2910 -0.6120 0.6790 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3560 2.1720 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 1.4460 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 1.8940 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.1160 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -0.4700 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -0.4910 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -3.3580 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -2.3290 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -0.3200 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 3.3640 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 4.5680 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 4.7450 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 5.6590 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 5.9060 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 4.5840 -3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 3.1860 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 2.0290 3.2130 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 3.9890 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 2.2260 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 7.8360 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 7.0700 -3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 6.4810 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.5080 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -2.3120 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.7310 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -4.3080 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -4.9660 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -5.0700 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 24 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 32 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 23 1 0 0 0 0 14 19 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 33 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 28 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 33 80 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 M END > 633 $$$$ 634 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 78 82 0 0 1 0 0 0 0 0999 V2000 1.7380 7.7210 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 6.7030 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 5.4140 -0.2940 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7150 5.5540 -1.2670 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0990 7.0180 -1.0370 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8330 -0.5460 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 -0.0700 -3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 1.3480 -3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6450 0.4080 -2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 1.8050 -1.8900 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1470 2.2880 -2.9280 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6000 3.7080 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3850 4.6360 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 2.7550 -1.9200 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2860 4.2290 -1.7760 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6150 3.1920 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 2.3560 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 4.6820 -1.0230 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0200 5.0640 -2.0400 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3510 6.5580 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 7.4230 -2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 4.8550 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 4.2240 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 7.2540 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 4.7760 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 4.5670 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 1.6880 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3400 1.3220 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0230 1.8250 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 2.3720 -3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 2.5940 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 3.8080 -1.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 3.5570 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 5.4220 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 7.9860 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 8.6100 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 7.0660 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 6.5050 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 5.3640 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4590 -1.5420 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3440 -0.6400 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6590 -0.7450 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3010 -0.0830 -4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 0.4800 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 0.0380 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 3.7750 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3670 4.0380 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 5.6600 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 4.5640 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 2.9530 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 2.9250 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 1.3000 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 2.5120 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 6.8100 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 6.7960 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 7.3000 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 8.4760 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 6.6480 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 8.3080 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 6.9750 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 3.7150 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 5.3650 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 5.0420 -4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 5.6490 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 4.1640 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 4.1280 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 0.8560 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 2.6120 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 1.5110 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2360 0.8090 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5930 2.3430 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9320 0.7950 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3200 1.8220 -5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4040 2.8350 -4.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8520 1.1530 -4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 4.0680 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 3.6060 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 2.5140 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 34 1 0 0 0 0 5 21 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 15 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 23 32 2 0 0 0 0 23 33 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 29 75 1 0 0 0 0 33 76 1 0 0 0 0 33 77 1 0 0 0 0 33 78 1 0 0 0 0 M END > 634 $$$$ 635 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 79 83 0 0 1 0 0 0 0 0999 V2000 1.1250 3.1440 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 1.8890 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 0.6680 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 2.7820 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 1.7010 1.3730 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9540 0.4540 0.9030 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1370 -0.6860 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -1.0720 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 1.3420 1.5120 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4630 0.1230 2.3760 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5020 2.1890 1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 2.5440 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7740 0.9740 2.7290 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9660 -0.2260 2.2600 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2820 -1.4640 3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -1.7190 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 1.2740 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 -0.2620 5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 -0.5590 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 0.3780 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 2.2900 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 0.7950 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.5390 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 0.1280 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 1.1080 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 1.5870 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2640 0.7210 2.8860 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5150 -0.5170 3.7420 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0080 -0.8060 3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 -0.8310 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5020 0.4970 1.8130 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9960 0.6450 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9660 1.5780 2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2470 0.4800 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.8550 -1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 3.8680 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 3.5880 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.3980 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 3.6690 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -0.4040 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -1.5630 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -1.9010 2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -1.3910 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 1.9930 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 3.0370 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 3.3880 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 2.8350 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -1.3980 4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -2.3340 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 -2.5980 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1700 -1.9200 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1410 -1.1420 5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 0.5950 5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -0.0580 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 0.3350 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -0.9130 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -1.3350 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -0.4420 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 1.3130 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 0.4440 3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.7920 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 1.4910 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 3.0080 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 0.9320 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -0.1100 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 1.6540 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -0.6410 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.4470 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.3800 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4590 -0.0380 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 -1.7740 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7940 -0.9800 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3370 -1.6490 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 -0.2320 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 1.5460 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9070 1.5320 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 -0.3370 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0880 1.4270 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3130 0.3380 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 35 2 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 10 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 10 14 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 28 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 18 28 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 74 1 0 0 0 0 32 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 M END > 635 $$$$ 636 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 2.0500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1020 1.5390 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 0.1140 -1.1860 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7860 -0.4860 -1.2220 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6340 -0.4800 1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -1.9120 -1.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.0020 -1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.5790 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 4.0700 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -0.3510 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -1.9000 1.5110 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8490 -0.3810 1.3920 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2460 0.0620 0.0530 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0050 -0.5620 -1.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -1.8770 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -2.5540 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -3.9380 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -4.6460 1.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -4.4890 -0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -6.0380 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -2.4060 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -3.0280 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -3.5340 4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -2.9760 6.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -2.2430 6.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -3.2930 7.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -2.7190 8.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.0180 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 0.7700 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8800 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3820 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 1.7210 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -0.1920 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.1650 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -1.4440 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -2.2880 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 1.7050 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 3.9060 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 3.9660 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 5.0340 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -2.1430 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 0.1080 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 1.1470 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 -2.4120 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 -6.4860 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -6.5280 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6690 -6.1600 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 -2.2550 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -3.1790 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -4.6220 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -3.2140 4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -1.6320 8.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -3.0400 8.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -3.0550 9.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -0.4070 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 1.0300 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 1.1590 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 9 1 0 0 0 0 1 32 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 35 1 0 0 0 0 6 8 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 23 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END > 636 $$$$ 637 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 0.0500 1.5580 0.9450 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0170 0.0410 1.1570 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4370 1.9640 0.4380 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7270 1.2580 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.1630 -0.6210 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3830 -0.6550 -0.1570 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9600 -0.3210 2.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -2.0680 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 1.9270 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 3.4700 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 3.8690 -0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -0.5210 0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -1.9880 1.4970 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0430 -0.5140 1.1150 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0820 -0.2060 -0.0410 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4650 -1.0200 -1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 -2.3260 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 -2.8360 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -4.2250 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -4.7910 1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -4.9080 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 -6.2130 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 -0.2590 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2010 0.6090 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -2.4080 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 -1.6950 3.7640 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8660 -2.1990 4.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 -1.5720 5.9600 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0420 -0.0640 5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 0.4660 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -0.2900 3.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -1.8730 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -2.1420 6.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 2.0620 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.2620 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 1.7190 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -0.6230 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -0.4180 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.2690 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -2.5740 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 1.6950 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 3.7030 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 4.0060 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 4.8140 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -2.1240 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 0.1170 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 0.8500 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -2.9940 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -6.6740 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 -6.5040 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -6.5460 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8710 -0.7930 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 1.1430 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 0.7920 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -3.4870 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -2.1380 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -1.7560 6.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 0.4370 6.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0420 0.1260 5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 0.3590 5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 1.5170 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9180 -1.9530 6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -1.6640 7.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8120 -3.2170 6.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 9 1 0 0 0 0 1 34 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 37 1 0 0 0 0 6 8 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 25 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 M END > 637 $$$$ 638 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -0.2340 1.0750 1.2010 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1370 -0.4520 1.2710 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1190 1.6450 0.7660 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4880 1.0820 -0.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -0.3390 -0.4780 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3080 -0.9880 -0.0930 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8180 -0.8250 2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -2.4060 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 1.4470 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 3.1650 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 3.7080 0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.7000 0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -2.0800 1.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9180 -0.5680 1.2950 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9510 -0.2360 0.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4210 -0.9050 -1.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -2.2000 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -2.8030 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -4.1720 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -4.8410 1.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 -4.7450 -0.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 -6.2450 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -0.1530 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 0.7120 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -2.4850 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -1.8020 3.8010 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0050 -2.1440 4.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 -1.5730 5.9420 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6490 -2.0280 6.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -1.6730 5.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -2.2380 4.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -0.7210 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 -2.0430 6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 1.4690 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.8670 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 1.3950 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -0.6850 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.7460 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.7800 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.8130 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 1.1150 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 3.4140 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 3.5860 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 4.6700 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -2.3450 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -0.0430 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 0.8410 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -2.7820 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -6.7200 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -6.4100 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -6.6750 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 -0.5680 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 1.1270 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 1.0090 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -3.5670 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 -2.1780 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -0.4860 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -3.1060 6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -1.5200 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -2.0800 6.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.5890 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -1.7280 6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 -1.6080 7.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 -3.1310 6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 9 1 0 0 0 0 1 34 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 37 1 0 0 0 0 6 8 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 25 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 M END > 638 $$$$ 639 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 97101 0 0 1 0 0 0 0 0999 V2000 1.4980 0.5140 -1.3770 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2360 -0.9640 -1.0750 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0070 0.7710 -1.3570 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6470 -0.0820 -2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -1.4760 -2.0490 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9860 -1.8240 -2.0970 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6990 -1.2730 0.2410 O 0 0 0 0 0 0 0 0 0 0 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O 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -3.8520 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -6.4950 -0.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -1.7400 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 -0.8530 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -1.1060 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -3.2670 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -5.5220 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 1.1320 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -1.1670 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 0.5630 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -2.0540 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.6240 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -2.1950 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -3.8100 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.6940 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 2.4180 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 2.8840 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 3.4130 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -3.1120 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 -3.3500 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 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0 1.6400 -1.4420 9.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -0.0540 8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -0.5920 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -4.6130 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 -2.3940 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 -0.7770 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -0.1980 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 9 1 0 0 0 0 1 57 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 60 1 0 0 0 0 6 8 1 0 0 0 0 6 61 1 0 0 0 0 7 62 1 0 0 0 0 8 63 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 65 1 0 0 0 0 10 66 1 0 0 0 0 11 67 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 13 56 1 0 0 0 0 14 46 1 0 0 0 0 14 68 1 0 0 0 0 14 69 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 51 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 18 70 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 71 1 0 0 0 0 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2.2420 -2.3330 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -3.6260 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 0.4010 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 2.6360 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 2.9500 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 3.9200 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 -2.5660 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -1.0330 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3930 -4.6910 7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4950 -5.9060 7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6270 -4.6850 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2220 -3.6030 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1210 -2.4430 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2190 -5.9880 5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0400 -5.2380 9.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6550 -4.5630 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6090 -3.0790 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9540 -2.7380 8.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 -0.4020 8.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 -0.8530 9.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -2.7180 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 -1.1020 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9510 1.8400 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6800 3.0830 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 3.1320 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 0.1840 7.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9130 2.0520 7.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 1.8770 7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 2.8640 11.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 0.2310 10.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 0.9530 9.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 0.0880 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -1.3240 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 0.6420 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 1.4990 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 0.0050 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 9 1 0 0 0 0 1 57 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 60 1 0 0 0 0 6 8 1 0 0 0 0 6 61 1 0 0 0 0 7 62 1 0 0 0 0 8 63 1 0 0 0 0 9 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0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 42 90 1 0 0 0 0 44 91 1 0 0 0 0 44 92 1 0 0 0 0 45 46 1 0 0 0 0 45 50 2 0 0 0 0 46 47 1 0 0 0 0 46 55 1 0 0 0 0 47 48 1 0 0 0 0 47 52 1 0 0 0 0 47 54 1 0 0 0 0 48 49 1 0 0 0 0 48 93 1 0 0 0 0 49 50 1 0 0 0 0 50 94 1 0 0 0 0 52 53 2 0 0 0 0 52 95 1 0 0 0 0 53 96 1 0 0 0 0 53 97 1 0 0 0 0 M END > 640 $$$$ 641 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 79 84 0 0 1 0 0 0 0 0999 V2000 0.8560 2.9440 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 1.6360 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 0.5760 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 2.7050 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 1.7340 1.3890 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7520 0.4330 1.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9330 -0.5920 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -0.9510 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 1.4190 1.5700 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2480 0.2950 2.5500 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2510 2.3380 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 2.6750 1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 1.2220 2.8150 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7560 -0.0410 2.4750 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0850 -1.1990 3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 -1.4100 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 -0.1280 4.0830 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0160 0.9810 3.0060 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7690 2.1560 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6850 -0.0380 4.3600 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8440 1.5020 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7810 0.5760 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -0.5050 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.8750 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4900 -0.4130 3.1130 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1830 0.5130 2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -1.7430 2.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9910 -0.3400 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -0.7620 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 2.4240 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 0.6920 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 0.1600 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 1.5990 3.8050 H 0 0 0 0 0 0 0 0 0 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0 0 0 3.7300 -0.7930 1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -0.7800 2.0480 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3780 -1.7790 3.1000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.8940 -3.0960 2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.0650 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 -1.8420 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -1.0060 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 0.6080 2.5920 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4420 2.5000 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 1.6040 1.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 2.1570 3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 0.9960 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 0.4500 4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 1.0460 5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 2.7590 4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 2.1950 5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 3.8710 3.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 2.9580 5.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 3.7560 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 3.4570 1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 0.6140 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 28 2 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END > 642 $$$$ 643 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 -0.0270 1.3620 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 1.8120 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 1.0360 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.1430 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.6300 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -0.1870 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -0.9960 -0.5610 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3780 -2.0140 0.4840 N 0 0 3 0 0 0 0 0 0 0 0 0 2.1660 -2.8150 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -1.9460 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -2.8700 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -1.4840 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 2.1190 -1.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 3.0090 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 1.5950 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 3.4050 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -0.0650 -0.2020 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4860 0.1420 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 0.5080 1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -0.7030 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -0.8480 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -1.5950 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 -2.2140 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 -1.3280 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 -2.0840 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 -1.3570 2.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4580 -2.5860 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2180 -2.4680 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 0.4620 3.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 0.7270 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 1.3830 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -0.2080 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -3.1400 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -3.6840 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -1.7620 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.4640 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -2.3700 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -3.8160 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -3.0620 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 1.4490 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 2.2960 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 0.6400 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 4.3760 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 3.4750 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 2.6660 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -1.7000 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4080 -2.8000 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -2.2530 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 -3.3770 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 6 2 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 2 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 25 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END > 643 $$$$ 644 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 0.1430 1.9950 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.4880 -0.3370 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3160 -0.2080 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 2.2640 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 1.6160 1.2790 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7460 0.1660 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -0.7880 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -0.5810 2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 1.7840 1.3390 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2280 0.8760 2.4430 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4740 3.4880 1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 3.2550 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 2.6310 2.8630 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6910 1.1210 2.6180 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5460 2.4220 2.9450 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8960 1.4660 1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 0.8510 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 1.4810 4.2080 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5510 2.3810 5.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 2.9260 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 0.4990 3.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 0.9160 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 3.5270 4.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 2.3350 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 0.2370 -0.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 1.0700 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 3.3080 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 2.5080 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 2.3580 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 0.1080 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 0.1130 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.2880 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 1.8460 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 3.3400 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -1.7990 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -1.2440 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -0.8120 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 1.5040 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 3.2360 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 4.5350 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 3.8700 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 3.5420 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 2.0230 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 0.6850 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 -0.2180 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 1.3700 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 1.7370 5.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 0.2900 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 0.3200 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 2.1470 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 1.9640 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 3.4070 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -0.7000 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 30 1 0 0 0 0 3 6 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 38 1 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 14 17 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 23 2 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 M END > 644 $$$$ 645 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4270 -0.5340 0.1380 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4060 -2.0640 0.1300 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8350 -2.5940 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 2.0200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -4.0190 0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.4660 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.0720 1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.5260 -1.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.3640 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.1740 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.4240 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -2.1710 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -2.3090 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 2.9850 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -4.4240 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.1830 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.3550 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.2430 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 M END > 645 $$$$ 646 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 86 0 0 1 0 0 0 0 0999 V2000 0.0480 0.6720 -0.6960 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2570 -0.8300 -0.4770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2040 -1.3650 -1.5560 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5180 -0.5820 -1.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2500 0.8100 -1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 1.3760 -0.6770 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1450 -0.7880 -0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 2.8680 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 1.1970 0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.5040 -0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.2030 -2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0020 1.5090 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7590 2.4000 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4720 1.7400 6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1500 0.4340 6.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2070 0.1820 5.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 1.0490 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -0.3450 -0.1790 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3220 -1.3200 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 0.9950 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 0.0190 2.7130 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7440 -1.3750 2.0840 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5610 -2.3500 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 -1.8760 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 0.4920 2.7790 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0680 -0.4820 3.6280 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7510 2.3600 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 1.8740 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6370 1.4260 4.2670 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4990 -0.0270 3.7810 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2700 -0.0360 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4970 0.8600 2.7370 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1070 1.7750 3.9120 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7080 -1.7130 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -0.0360 4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 0.6360 4.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -0.5310 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 -0.8930 4.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3450 1.5520 5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 0.0530 3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6690 0.5400 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2410 2.2920 7.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 0.8370 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.9980 0.5070 H 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 -8.4620 -17.2180 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 -16.5870 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -18.1630 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 -12.9650 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -12.3340 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -13.9090 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -5.8500 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6850 -4.9060 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -6.4810 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -1.6130 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -0.6690 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -2.2440 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -1.8350 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.7410 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -0.9160 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.3320 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 1.8110 -4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.4700 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 2.7320 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 3.2320 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 1.7140 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 2.2240 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 46 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 33 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 17 18 2 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 21 22 2 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 2 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 39 1 0 0 0 0 29 30 2 0 0 0 0 29 64 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 37 79 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 38 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 39 85 1 0 0 0 0 39 86 1 0 0 0 0 39 87 1 0 0 0 0 40 88 1 0 0 0 0 40 89 1 0 0 0 0 40 90 1 0 0 0 0 41 91 1 0 0 0 0 41 92 1 0 0 0 0 41 93 1 0 0 0 0 42 94 1 0 0 0 0 42 95 1 0 0 0 0 42 96 1 0 0 0 0 43 97 1 0 0 0 0 M END > 647 $$$$ 648 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 80 81 0 0 1 0 0 0 0 0999 V2000 0.3250 1.1010 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -0.1560 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -1.2690 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -1.1500 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.1210 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 1.2410 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -2.3480 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 2.1470 -0.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.9590 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.2990 -2.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 1.9510 -1.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4060 3.2810 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 3.6820 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 1.4790 -2.4410 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3590 -0.0090 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.5630 -3.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -1.9510 -4.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0540 -2.8500 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -0.6540 -1.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -4.0260 -3.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 2.1900 -3.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 2.7300 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 3.4600 -5.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0110 2.6280 -4.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -2.4520 -3.8140 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5630 -1.5120 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0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -5.1820 6.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -6.2400 6.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 3.1230 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 3.6030 4.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 0.1570 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 0.8890 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 0.6020 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -0.4180 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -4.8200 7.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -5.5120 8.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -6.5660 8.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -6.9320 7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 4.8000 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 4.6540 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 3.4990 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 4.6720 5.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8420 2.4610 5.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 4.7320 4.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 4.5160 7.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 3.3460 7.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 4.4300 7.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 5.9130 5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 7.1690 4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 8.2520 5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 8.0800 6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 6.8240 6.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 5.7400 6.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -4.2030 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -5.1850 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -1.8720 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.9010 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -4.0990 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -5.0900 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -5.3790 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -2.6160 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 -1.9470 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -0.5220 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.2220 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.6040 5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 0.2500 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 2.2420 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -5.0690 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -4.1250 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -6.5250 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.7830 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 2.8570 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 0.3820 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 1.6860 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 1.1730 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 -0.6430 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -3.9970 7.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -5.2300 9.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -7.1070 9.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -7.7550 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 4.8200 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 5.7040 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 4.9760 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 5.2030 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 5.5940 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 4.8380 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 3.8150 4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 2.4360 7.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 3.3470 8.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 3.3880 6.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 5.3350 7.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 4.3260 8.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 3.5640 7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 7.3030 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 9.2330 4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 8.9260 6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 6.6900 7.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 4.7590 6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 2 3 2 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 54 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 55 1 0 0 0 0 6 56 1 0 0 0 0 7 9 2 0 0 0 0 7 57 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 58 1 0 0 0 0 10 18 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 60 1 0 0 0 0 12 13 1 0 0 0 0 12 30 2 0 0 0 0 13 33 2 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 16 63 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 64 1 0 0 0 0 18 20 2 0 0 0 0 21 22 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 28 1 0 0 0 0 23 29 1 0 0 0 0 23 66 1 0 0 0 0 25 26 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 27 1 0 0 0 0 26 34 2 0 0 0 0 27 37 2 0 0 0 0 27 69 1 0 0 0 0 28 39 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 29 38 1 0 0 0 0 29 40 1 0 0 0 0 30 31 1 0 0 0 0 30 72 1 0 0 0 0 31 32 2 0 0 0 0 31 73 1 0 0 0 0 32 33 1 0 0 0 0 32 74 1 0 0 0 0 33 75 1 0 0 0 0 34 35 1 0 0 0 0 34 76 1 0 0 0 0 35 36 2 0 0 0 0 35 77 1 0 0 0 0 36 37 1 0 0 0 0 36 78 1 0 0 0 0 37 79 1 0 0 0 0 38 39 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 40 41 1 0 0 0 0 40 42 2 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 41 84 1 0 0 0 0 43 47 1 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 45 87 1 0 0 0 0 45 88 1 0 0 0 0 45 89 1 0 0 0 0 46 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 47 48 1 0 0 0 0 47 52 2 0 0 0 0 48 49 2 0 0 0 0 48 93 1 0 0 0 0 49 50 1 0 0 0 0 49 94 1 0 0 0 0 50 51 2 0 0 0 0 50 95 1 0 0 0 0 51 52 1 0 0 0 0 51 96 1 0 0 0 0 52 97 1 0 0 0 0 M END > 651 $$$$ 652 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.5340 -0.1130 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4060 -2.0640 -0.0600 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7240 -2.5090 1.2380 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6810 -1.9030 1.3000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5880 -0.4790 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9980 -0.1070 -1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -2.5650 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -3.9340 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -2.2670 2.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.8460 2.6470 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4690 -2.5410 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -2.3920 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 -2.0220 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -2.1770 4.0480 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6620 -1.7360 4.1510 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5670 -0.2120 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.8710 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -2.2300 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -3.2370 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -1.2840 5.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3270 -0.0390 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 -1.8920 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 -1.5200 4.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 -2.1170 1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -0.1430 5.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 2.0200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.1500 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -2.4500 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -2.1650 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.2790 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -0.3550 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -0.4120 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -3.5290 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -4.2860 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.7710 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -2.5780 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 0.1540 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 0.3090 3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.2410 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -1.7610 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -1.8200 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 0.0250 6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 0.8590 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4120 -1.4590 3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 0.1510 5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 2.9850 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 23 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 22 1 0 0 0 0 19 27 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END > 652 $$$$ 653 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 26 26 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 2.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 1.9990 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 3 0 0 0 0 0 0 0 0 0 -1.3950 -1.9810 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 2.1940 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 2.6730 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 3.0060 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 2.8570 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 2.3830 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 3.1830 2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.4760 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.7240 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.1480 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -2.3310 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -2.3470 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.3560 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 1.9350 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 2.7860 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 2.2670 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 4.1030 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 4.4380 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 8 1 0 0 0 0 3 12 2 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 M END > 653 $$$$ 654 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 43 0 0 1 0 0 0 0 0999 V2000 0.0570 1.3590 0.2220 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4700 1.9730 0.0110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9760 1.8700 1.4700 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2510 -0.1470 0.3380 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0540 -0.7920 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -0.5880 1.3080 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4070 0.4130 1.6900 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6130 0.2280 3.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -0.1860 3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.0120 4.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -0.7940 2.4040 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6420 -0.9030 2.6510 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2370 -1.9760 2.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -1.8700 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.5570 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 1.1250 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.1440 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 1.6980 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 3.3310 -0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.9310 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 2.0550 2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 2.2230 1.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 1.6270 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 2.5810 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -0.1920 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -1.8110 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 0.2050 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.1880 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -1.7060 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -2.1390 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.6760 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.0990 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 2.1700 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.5400 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 0.7350 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.7780 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 1.0390 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 2.6860 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 3.7470 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 20 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 19 1 0 0 0 0 3 7 1 0 0 0 0 3 21 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 5 11 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 M END > 654 $$$$ 655 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 81 87 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.5970 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 1.8840 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 0.8250 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -0.1200 0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 0.2840 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 0.8040 1.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 5.8310 -9.3160 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.3520 6.3400 -8.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0520 5.1770 -7.2010 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3890 4.1350 -7.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 3.5880 -8.9940 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4630 4.6870 -10.0140 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7090 3.8480 -5.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 4.6490 -5.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7420 5.3410 -3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 4.7920 -5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 5.4860 -4.2570 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5450 6.2880 -3.8870 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3520 7.0150 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 6.0090 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 4.4450 -3.1690 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8720 5.1690 -1.8370 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9400 4.5640 -0.8050 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1480 3.2750 -1.0840 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7190 2.5480 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 3.5440 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 4.5460 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 3.4790 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 2.4220 0.1920 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6020 5.7480 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 3.6180 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 5.6320 -6.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 6.8940 -10.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 7.6620 -9.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 5.1780 -10.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 7.0300 -4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 6.4280 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 2.4690 -9.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 3.8140 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 2.7620 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.4640 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 0.4170 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1600 5.4680 -8.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 6.7480 -8.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 7.1170 -7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 4.7950 -6.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 3.1860 -8.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 4.2820 -10.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 3.0980 -4.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 3.3540 -6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 3.9760 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 5.9100 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 4.5910 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 4.2220 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 5.5420 -6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 7.6960 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 7.5860 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 6.5410 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 5.3640 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 1.7400 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 2.1370 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 3.0020 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 4.1460 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 5.5220 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 4.2600 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 3.9100 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 3.0420 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 1.7830 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 4.0180 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 2.7180 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 4.3620 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7020 8.4480 -10.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4780 7.0130 -10.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5260 8.1110 -8.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 4.5060 -11.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 7.1780 -5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 6.9220 -3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 5.8560 -4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 1.6860 -8.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9510 2.0510 -10.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 2.8710 -10.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 33 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 47 1 0 0 0 0 12 35 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 51 1 0 0 0 0 15 18 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 22 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 33 34 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 35 75 1 0 0 0 0 37 76 1 0 0 0 0 37 77 1 0 0 0 0 37 78 1 0 0 0 0 38 79 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 M END > 655 $$$$ 656 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -1.1000 1.2080 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -0.2140 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.1690 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 0.4730 2.3790 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1940 1.8960 1.8870 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2100 1.8500 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 2.5280 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 3.6410 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 4.2540 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 5.3830 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 6.0600 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 7.1160 2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 3.6290 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2640 5.6870 0.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 1.0230 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 3.2730 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 2.6680 2.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 0.5180 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -0.2990 1.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 1.1760 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 1.7970 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.6710 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.8030 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 0.4200 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -1.1820 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 2.0790 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 4.0890 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 5.7690 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 7.5110 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 4.1160 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 3.7510 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 2.5670 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 1.1480 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 1.3620 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -0.0290 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 3.8620 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 3.7300 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 3.2400 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.7390 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -0.4950 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 0.9750 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 1.1070 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -1.2140 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 M END > 656 $$$$ 657 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 0.2140 1.1430 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.2980 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -0.3640 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 2.0810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 1.9360 1.0200 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7430 0.5180 1.5090 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8210 -0.0460 0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 0.8610 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 2.2400 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 1.8530 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 3.5180 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 2.8220 2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 0.6170 -1.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 0.6560 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 1.2050 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 1.4400 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.9630 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -0.5910 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.0330 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -1.3930 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.8800 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 2.6940 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.7760 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 2.6900 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 0.9300 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 3.6910 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 4.2120 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 3.6750 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 2.7680 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -0.3310 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 1.2780 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 1.1180 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 M END > 657 $$$$ 658 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.2910 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.8430 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -0.3500 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 0.9150 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 2.1660 -0.9240 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0190 2.3070 0.0050 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6230 2.6930 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 3.6750 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 3.3720 -0.5000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3680 3.5030 -0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 2.2110 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 4.5060 -1.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 3.0000 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 1.8640 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.9170 0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -1.0600 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.3460 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -0.5770 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -0.5110 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 0.9150 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 0.9470 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 3.1890 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 1.8160 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 4.7030 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 3.5150 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 3.7790 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 5.2980 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 2.1320 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 2.7630 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 3.8390 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 1.0520 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 2.4730 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 2.4820 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.1350 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -3.0250 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -2.8070 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -0.9820 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -0.9130 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 0.5120 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 16 2 0 0 0 0 4 5 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 M END > 658 $$$$ 659 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 83 88 0 0 1 0 0 0 0 0999 V2000 0.3430 1.5340 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 0.0210 0.2620 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8850 -0.6980 1.4260 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8230 1.9060 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 1.2790 1.6060 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3160 -0.2310 1.5720 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0350 -0.8630 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -0.6970 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 1.5520 1.4580 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9200 0.7740 2.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3200 3.0480 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3790 0.9070 1.9210 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3330 0.2220 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7380 0.7470 2.8880 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8020 3.2760 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 2.3480 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 2.8270 1.6630 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7880 2.2880 2.9530 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3320 2.4690 2.8710 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6480 1.4530 1.7420 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3140 2.1820 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 2.3050 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6360 0.4050 1.8490 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0 0 0 0 0 0 7.0440 -0.0400 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -4.7520 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 2 55 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 58 1 0 0 0 0 7 20 1 0 0 0 0 7 59 1 0 0 0 0 8 60 1 0 0 0 0 9 10 1 0 0 0 0 9 61 1 0 0 0 0 9 62 1 0 0 0 0 10 63 1 0 0 0 0 11 64 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 12 65 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 66 1 0 0 0 0 14 15 1 0 0 0 0 14 67 1 0 0 0 0 14 68 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 69 1 0 0 0 0 17 19 1 0 0 0 0 17 70 1 0 0 0 0 18 71 1 0 0 0 0 19 72 1 0 0 0 0 21 73 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 22 38 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 25 27 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 74 1 0 0 0 0 29 30 2 0 0 0 0 29 42 1 0 0 0 0 30 31 1 0 0 0 0 30 75 1 0 0 0 0 31 41 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 76 1 0 0 0 0 34 35 1 0 0 0 0 34 39 1 0 0 0 0 35 36 2 0 0 0 0 35 40 1 0 0 0 0 36 37 1 0 0 0 0 36 77 1 0 0 0 0 37 78 1 0 0 0 0 39 44 1 0 0 0 0 40 43 1 0 0 0 0 41 79 1 0 0 0 0 42 80 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 43 83 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 84 1 0 0 0 0 45 49 1 0 0 0 0 46 47 1 0 0 0 0 46 51 1 0 0 0 0 46 85 1 0 0 0 0 47 48 1 0 0 0 0 47 54 1 0 0 0 0 47 86 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 87 1 0 0 0 0 49 52 1 0 0 0 0 49 88 1 0 0 0 0 50 89 1 0 0 0 0 51 90 1 0 0 0 0 52 53 1 0 0 0 0 52 91 1 0 0 0 0 52 92 1 0 0 0 0 53 93 1 0 0 0 0 54 94 1 0 0 0 0 M END > 662 $$$$ 663 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 19 20 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.6910 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 0.0030 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.0830 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.3900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 2.0800 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 3.4220 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 4.1790 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 3.5470 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.0490 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 4.0000 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -0.6980 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -0.5360 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 5.2580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 4.1100 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.4380 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -0.8940 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 13 19 1 0 0 0 0 M END > 663 $$$$ 664 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7850 -0.4890 -1.2210 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1060 0.0540 -1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 1.4820 -1.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4220 2.0470 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1160 -4.5360 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.7520 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -2.5180 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.9160 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -4.6580 -1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -3.9110 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.9480 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 1.5180 -2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.9900 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.5000 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -2.3760 -4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -3.7790 -4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -4.3760 -5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -3.6600 -6.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -2.2520 -6.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -1.5900 -5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -4.2430 -7.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 3.4740 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.3670 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.1600 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 1.8370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.7260 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -5.6130 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -0.6750 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -4.8300 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.0360 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 1.5200 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.7790 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 1.6930 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -1.4640 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -1.7020 -7.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -0.5110 -5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 3.9000 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 15 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 28 1 0 0 0 0 6 24 1 0 0 0 0 6 29 1 0 0 0 0 7 12 2 0 0 0 0 7 18 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 24 40 1 0 0 0 0 M END > 664 $$$$ 665 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 158165 0 0 1 0 0 0 0 0999 V2000 0.4900 3.5090 0.7970 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1180 2.0320 0.9490 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2100 1.3460 -0.4180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6230 1.5340 -0.9770 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9380 3.0300 -1.0550 C 0 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0 10 73 1 0 0 0 0 11 74 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 75 1 0 0 0 0 12 76 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 14 77 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 15 78 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 79 1 0 0 0 0 17 18 1 0 0 0 0 17 80 1 0 0 0 0 18 19 1 0 0 0 0 19 81 1 0 0 0 0 20 82 1 0 0 0 0 21 83 1 0 0 0 0 22 84 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 29 1 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 85 1 0 0 0 0 25 26 1 0 0 0 0 25 86 1 0 0 0 0 26 27 1 0 0 0 0 27 87 1 0 0 0 0 27 88 1 0 0 0 0 28 89 1 0 0 0 0 29 90 1 0 0 0 0 30 31 1 0 0 0 0 30 91 1 0 0 0 0 30 92 1 0 0 0 0 31 93 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 34 94 1 0 0 0 0 34 95 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 96 1 0 0 0 0 37 97 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38 62 1 0 0 0 0 39 40 1 0 0 0 0 39 52 1 0 0 0 0 40 41 1 0 0 0 0 40 98 1 0 0 0 0 40 99 1 0 0 0 0 41 43 1 0 0 0 0 41100 1 0 0 0 0 41101 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 42 60 1 0 0 0 0 43 47 1 0 0 0 0 43 61 1 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 44102 1 0 0 0 0 45103 1 0 0 0 0 45104 1 0 0 0 0 46 47 1 0 0 0 0 46 51 1 0 0 0 0 47 48 1 0 0 0 0 47 53 1 0 0 0 0 48 49 1 0 0 0 0 48105 1 0 0 0 0 48106 1 0 0 0 0 49 50 1 0 0 0 0 49107 1 0 0 0 0 49108 1 0 0 0 0 50 51 1 0 0 0 0 50109 1 0 0 0 0 51110 1 0 0 0 0 51111 1 0 0 0 0 52112 1 0 0 0 0 52113 1 0 0 0 0 52114 1 0 0 0 0 53115 1 0 0 0 0 53116 1 0 0 0 0 53117 1 0 0 0 0 54 55 1 0 0 0 0 54118 1 0 0 0 0 54119 1 0 0 0 0 55 57 1 0 0 0 0 55120 1 0 0 0 0 55121 1 0 0 0 0 56 57 1 0 0 0 0 56 59 1 0 0 0 0 56122 1 0 0 0 0 56123 1 0 0 0 0 57 58 1 0 0 0 0 57124 1 0 0 0 0 58125 1 0 0 0 0 58126 1 0 0 0 0 58127 1 0 0 0 0 M END > 668 $$$$ 669 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 47 51 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.5200 0.0380 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3850 2.1110 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.0520 0.0700 N 0 0 3 0 0 0 0 0 0 0 0 0 0.5390 -0.4950 -1.2000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4160 -0.1520 -2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 0.7820 -1.8180 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2230 0.0160 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.4970 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 0.1640 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.3380 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.2910 -2.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 0.5880 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 1.6520 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 2.7220 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 2.6910 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 1.6560 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 0.5850 -2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -0.1830 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -1.5340 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 0.3550 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.9910 -1.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5580 2.7260 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 2.6220 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 3.1150 -3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.5740 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8660 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 3.1570 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 2.0400 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 0.3490 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.0670 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 1.0770 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -1.5860 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -0.1360 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 3.5340 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 3.5010 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 1.6860 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -0.2170 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -0.7320 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -2.3500 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -1.7580 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -1.4200 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 1.4390 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -0.0790 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 0.0920 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 3.4460 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 1.8720 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 3.5290 -3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 21 1 0 0 0 0 1 26 1 0 0 0 0 2 10 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 M END > 669 $$$$ 670 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.1540 1.4990 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -0.0020 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.3890 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 2.1140 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -0.6220 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.1040 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -0.7570 0.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.0530 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -2.0590 0.1280 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7400 -4.1810 0.7820 N 0 0 3 0 0 0 0 0 0 0 0 0 2.3140 -3.9460 -0.5620 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9170 -2.1850 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -3.0820 1.0550 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9110 -4.4210 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -5.0570 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -4.9670 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -6.2950 3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -2.8040 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.8160 1.3230 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9020 -2.8100 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -0.3160 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -3.3560 -0.4260 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8090 -2.0470 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -2.3350 -2.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -3.0230 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 2.0760 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -0.5710 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 1.9120 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 3.1930 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -4.8400 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -2.0820 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -1.2020 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -2.6350 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -5.1560 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -6.0380 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -4.4660 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -7.0500 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -6.5870 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -6.2090 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -3.2180 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1400 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 0.7740 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -0.6870 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -0.7050 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -4.0640 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -1.4320 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -1.5110 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -1.5500 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 5 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 25 2 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 19 1 0 0 0 0 11 18 1 0 0 0 0 11 22 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 M END > 670 $$$$ 671 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 42 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 1.8910 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 0.7640 -0.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3010 -0.4500 -0.4290 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7650 -1.4870 0.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 0.4060 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -0.9360 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -1.5380 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -0.8020 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 1.1670 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 0.5650 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 3.3270 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 2.4520 2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 2.7670 4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 1.3830 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 1.0460 6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 2.3810 6.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 3.4320 5.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -1.3930 5.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -2.7860 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 4.6240 5.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 4.4960 3.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 0.9420 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -0.8180 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 1.9260 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 2.9480 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -2.5870 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 0.5890 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 0.3700 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 2.5780 7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 2.3620 7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -3.3430 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -3.1330 6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -2.9430 4.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -1.0790 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.6700 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 0.0320 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 26 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END > 671 $$$$ 672 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4310 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 1.8580 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.7710 -0.9230 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2340 -0.4810 -0.5560 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0050 -1.0910 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 0.3940 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -0.7320 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -1.3400 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -0.8000 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 0.9550 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 0.3760 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 2.8820 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 2.0190 -1.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 2.2770 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0710 1.0260 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 0.6170 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 1.7560 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 2.7750 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 -1.4020 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 -2.5940 2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 3.8270 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 4.0770 -1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 1.0300 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -1.4170 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.8070 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.7980 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 2.8510 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 1.8110 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 -2.2380 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 0.5000 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7240 -0.3150 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8930 2.1960 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1040 1.3820 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 -2.9720 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -2.3740 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -3.3460 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -1.7620 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -2.2740 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -0.8820 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END > 672 $$$$ 673 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 39 43 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3470 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 1.8910 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 0.7640 -0.0270 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3000 -0.4500 -0.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7650 -1.4870 0.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 0.4060 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -0.9360 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -1.5320 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 -0.7970 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 1.1610 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 0.5690 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 3.2760 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 2.4500 2.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 2.7230 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 1.3520 4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 1.6560 6.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 3.0050 6.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 3.5770 5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -1.3870 5.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -2.7750 5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 4.7430 5.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 4.4330 3.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 0.7320 6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 0.9420 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -0.8180 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 1.9260 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 2.9480 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -2.5780 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 1.6700 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 1.2930 7.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -3.1220 6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -2.9200 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -3.3430 4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 0.5650 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -0.2230 5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -1.0780 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.6690 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 0.0320 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 27 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END > 673 $$$$ 674 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 1.9190 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.6350 0.0180 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2800 -0.4600 0.4590 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3440 -0.3870 1.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 0.6880 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 0.0420 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -0.0930 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 0.4350 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 1.2230 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 1.1260 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 2.7640 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 1.8150 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 2.5400 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 1.7190 2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 1.7610 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8120 3.0600 3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 3.1540 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 0.2910 4.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -0.4210 5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7340 3.7200 0.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 3.7660 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1970 1.4760 4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 0.4250 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -1.4490 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.7930 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.7830 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 2.4930 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 2.5230 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -0.6160 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0860 0.9870 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2200 1.7680 4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 0.0920 6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -1.4330 5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 -0.4640 6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 2.1300 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 0.4370 4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END > 674 $$$$ 675 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.4420 1.4730 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -0.0270 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.8210 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.8310 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.1070 1.3160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1760 -0.3950 1.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6030 -1.1180 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -0.9270 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 0.5720 2.6580 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8960 1.3690 1.4650 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6820 1.6930 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 2.8620 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 1.2290 3.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -0.7120 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -2.3030 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 3.1700 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 3.9760 2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 0.9760 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 4.1480 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 4.8800 3.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 4.7080 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 3.9510 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 4.5060 5.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.0140 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 1.7670 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -0.2860 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -0.2950 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 1.5360 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 2.9100 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -0.7320 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -0.7360 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -2.1880 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -1.3740 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -1.4040 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 1.0600 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.6340 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.1270 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 2.7350 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 3.4400 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 3.1260 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.2170 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -1.1810 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 0.3380 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -2.4110 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.9170 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -2.6250 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 2.7390 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 0.1750 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 1.8120 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2290 3.6230 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 5.7070 3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 4.7880 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 2.9120 4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 18 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 M END > 675 $$$$ 676 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.6930 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.1000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0040 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -0.6610 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -0.0510 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 1.3010 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1240 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 1.9300 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 3.3200 0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 1.7700 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9210 2.3560 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 3.1060 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 3.2680 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 2.6880 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7830 3.6820 -1.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 2.0570 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -0.6920 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 3.4850 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 4.4400 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.7730 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 3.1800 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -0.6600 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 1.1860 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3490 2.2320 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 3.8510 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 2.8140 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.8870 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 3.8240 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 3.8330 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 3.8880 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 5.2590 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6120 3.7940 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3590 4.8440 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 6 2 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 11 17 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 22 1 0 0 0 0 19 21 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END > 676 $$$$ 677 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6780 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.0300 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -0.6700 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 0.0200 -0.3990 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8390 1.3300 0.3950 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6660 2.2170 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -0.8320 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -0.8020 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 -1.5790 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 -2.3890 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 -2.4170 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 -1.6390 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.4470 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7000 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 1.9960 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2650 -3.1540 0.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9110 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -1.7580 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 0.2390 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 1.1180 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 2.5940 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 3.0550 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0710 -0.1720 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 -1.5550 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 -3.0470 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -1.6610 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.8360 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.8970 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 2.8330 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 -2.7130 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 6 2 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 M END > 677 $$$$ 678 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 66 71 0 0 1 0 0 0 0 0999 V2000 0.1530 1.3600 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.0880 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 0.0520 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 1.4350 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 2.2610 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 1.4110 -1.6080 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0340 0.0760 -2.2220 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2460 -0.6250 -1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -0.0260 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.6770 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -2.6460 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -3.6870 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -3.6290 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -3.1070 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -3.2260 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.7030 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.1830 0.0090 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5150 -2.7290 -1.1800 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9790 -2.5190 -0.9000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3400 -3.3110 0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -2.9480 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -2.0130 -3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -2.4030 -4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -3.7350 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -4.6710 -3.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.2760 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -0.7440 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -0.7020 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -1.4520 -4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -2.2490 -3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -2.2900 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 -1.5330 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -2.0280 -2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 2.0910 -2.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -2.1300 2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -0.7430 1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 3.4450 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -4.0800 4.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -4.1220 -5.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 -2.9890 -3.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.8710 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 2.6100 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 3.1190 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 1.2300 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 0.2610 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -4.0930 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -3.0620 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -2.5050 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -3.7930 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.4660 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.9760 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -1.6730 -4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -5.7080 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -5.0050 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -0.0820 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -1.4190 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -2.9090 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -1.5610 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -2.3250 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 2.9520 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.1780 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -0.8870 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 3.8610 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -5.0170 5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -4.3800 -6.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 -2.5290 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 41 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 45 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 17 1 0 0 0 0 11 14 2 0 0 0 0 11 16 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 40 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 36 62 1 0 0 0 0 37 63 1 0 0 0 0 38 64 1 0 0 0 0 39 65 1 0 0 0 0 40 66 1 0 0 0 0 M END > 678 $$$$ 679 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0750 1.4720 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 0.0400 0.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -0.0050 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -0.6580 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -2.0520 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7710 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -2.1250 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.7420 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.3580 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 2.1350 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 3.5070 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 4.0940 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 3.3240 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 1.9670 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 2.1030 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -2.7060 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -0.1040 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 0.1770 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -2.9280 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.0650 -2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -4.2540 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -5.4760 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -4.4000 -4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 4.2540 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 3.9060 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8500 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 5.1500 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 1.3820 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -2.9120 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 0.6860 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -0.7560 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 0.8150 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -3.9170 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -2.4200 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.1840 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -5.7960 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -6.2780 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -5.2380 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -3.4150 -4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -4.8740 -4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -5.0150 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 4.6400 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 4.2490 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 1 15 2 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END > 679 $$$$ 680 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -1.6650 -1.5460 5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.0760 4.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -1.6870 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -1.4280 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.5420 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.9120 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -2.1780 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -2.0650 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -0.6550 6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.8610 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.4280 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.2140 8.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 0.4240 8.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -0.0040 6.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -1.9640 5.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -1.2860 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -2.3200 3.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -3.6660 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -2.5770 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -3.8490 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 0.6410 9.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 1.2960 10.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -4.8100 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -5.8130 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -5.5580 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -4.0850 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -1.9960 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -0.5920 7.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 0.9280 8.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.1660 6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -2.0620 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -3.7310 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -4.3270 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -3.9650 4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 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0 0 0 0 0 0 3.4350 2.2990 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 4.6890 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 2.0680 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.2490 0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -4.2350 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 4.2970 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 4.9810 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 4.3100 -2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -5.1800 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -6.5260 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -6.9290 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -5.9790 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.6350 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 5.9170 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 6.9240 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 6.7040 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 5.4710 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 4.4680 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 4.9690 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 5.6060 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 6.2720 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 6.2940 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 5.6570 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -8.2520 -0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 7.6930 2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 7.3950 3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 6.9010 0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 5.6760 -2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -0.4960 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.6210 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -2.4140 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -2.7800 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 4.0120 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 3.6970 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 2.2570 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.8660 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -7.2630 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -6.2900 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -3.8950 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 6.0880 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 7.8830 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 5.2960 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 3.5080 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 4.4540 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 5.5940 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 6.8120 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -8.6460 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 7.1310 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 6.5580 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 8.2680 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 7.8250 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 6.4240 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 2 0 0 0 0 1 15 1 0 0 0 0 2 4 1 0 0 0 0 2 9 2 0 0 0 0 2 41 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 14 26 1 0 0 0 0 14 30 2 0 0 0 0 15 47 1 0 0 0 0 17 21 1 0 0 0 0 17 25 2 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 31 1 0 0 0 0 19 35 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 37 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 39 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 40 1 0 0 0 0 36 59 1 0 0 0 0 37 38 1 0 0 0 0 38 60 1 0 0 0 0 38 61 1 0 0 0 0 38 62 1 0 0 0 0 39 63 1 0 0 0 0 40 64 1 0 0 0 0 M END > 681 $$$$ 682 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 66 0 0 1 0 0 0 0 0999 V2000 0.0320 1.4350 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 0.0280 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0320 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.6750 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -2.0280 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.7410 0.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1860 -2.2000 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -0.7190 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 1.4170 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.1180 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 2.1160 0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -0.1830 1.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -4.2070 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -5.1560 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -6.5000 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -6.8970 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -5.9420 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -4.5990 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -8.2190 -0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 3.6250 0.0600 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0130 4.1800 -0.7470 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1210 3.7460 -2.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 4.1380 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 4.1600 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 3.9630 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 3.9920 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 4.2080 -4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 4.3980 -4.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 4.3750 -2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 5.6860 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 7.7210 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 8.4510 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 7.7920 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 6.4110 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 6.3410 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 9.8090 -0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 4.2360 -6.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 4.5100 0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 2.0950 -0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -0.5040 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -2.6070 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.3430 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -2.7150 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 2.2950 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -4.8470 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -7.2420 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -6.2480 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -3.8560 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -8.5940 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.9760 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 3.8150 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 3.8450 -4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 4.5630 -4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 4.5220 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 8.2320 1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 8.3580 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 5.8980 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 5.7720 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 10.1860 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 5.1140 -6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 2.2290 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 2 0 0 0 0 1 11 1 0 0 0 0 2 4 1 0 0 0 0 2 9 2 0 0 0 0 2 40 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 20 1 0 0 0 0 11 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 51 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 37 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 34 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 35 2 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 37 60 1 0 0 0 0 39 61 1 0 0 0 0 M END > 682 $$$$ 683 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.3750 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0080 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -0.6790 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.4140 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0300 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -0.4190 -0.0490 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6000 0.8870 -0.4390 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6920 1.9050 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 0.9680 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -0.8990 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -2.0360 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 2.0320 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.5690 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 4.2970 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 5.6450 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 6.3770 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 4.1810 -1.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 7.7740 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 8.4540 3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 7.7560 4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 6.3680 4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 5.6790 3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 0.5400 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 0.6130 -3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 1.1160 -4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 1.5440 -4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 1.4640 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -0.0990 2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -2.7830 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -2.3310 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -3.2580 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -4.5920 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -5.0420 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -4.1390 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -1.8960 3.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -6.3710 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 1.1890 -6.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 8.4310 6.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.5640 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -1.1920 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 0.9640 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -2.4240 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 2.2180 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 3.7560 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 6.1860 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 8.3170 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 9.5320 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 5.8300 5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 4.6010 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 0.1490 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 0.2790 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 1.9360 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 1.7980 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -2.9170 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -5.3020 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -4.4940 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -1.5700 4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -6.8210 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 0.3970 -6.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 8.6810 6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 3 6 2 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 42 1 0 0 0 0 10 24 1 0 0 0 0 10 28 2 0 0 0 0 11 29 2 0 0 0 0 11 31 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 30 36 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 35 57 1 0 0 0 0 36 58 1 0 0 0 0 37 59 1 0 0 0 0 38 60 1 0 0 0 0 39 61 1 0 0 0 0 M END > 683 $$$$ 684 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.0490 1.8980 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.3960 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -0.1840 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 2.4100 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 2.0100 -1.0090 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3000 0.4870 -1.1100 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1840 0.0450 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 0.4630 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 2.4800 -0.8160 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7150 1.9920 -1.8490 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0240 2.3220 -1.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 3.6370 -0.9360 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2290 4.2560 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 3.9940 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -0.3280 0.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 0.1340 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 2.6860 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -1.6840 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.0830 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 2.5950 -3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 3.5450 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 4.5760 -2.0970 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8420 4.0130 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 5.8660 -1.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 5.0400 -4.3340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 2.0470 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.3630 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 2.1370 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 3.4950 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 1.9740 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -1.0440 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 0.4800 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 0.0080 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 0.1340 -2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 3.8240 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 5.3340 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 4.5100 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 4.3590 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 3.7610 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 2.2920 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 2.4890 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -2.1710 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -2.1500 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -1.7880 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 0.9450 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -0.3780 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -0.7430 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 2.1410 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 3.6700 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 2.4050 -3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 3.1390 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 4.5390 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 2.8920 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 4.6610 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 4.0110 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 2.9940 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7550 5.8660 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 15 2 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 54 1 0 0 0 0 23 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 M END > 684 $$$$ 685 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -0.4080 1.5290 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 0.0190 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6700 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 2.0660 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 1.5190 -1.4280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9830 -0.0020 -1.4080 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9890 -0.5120 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -0.1140 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 2.0000 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 3.3380 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 3.3840 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -0.6270 0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -0.2970 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 2.0780 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -2.1360 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.6780 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 1.2730 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 1.8780 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 4.7190 1.4750 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8430 5.7450 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 4.6740 3.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1680 5.0940 1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 6.0810 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 4.1880 3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 6.0050 5.3640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 1.8910 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 1.8640 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 3.1560 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 1.7610 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -1.6040 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -0.1000 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -0.8170 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -0.1660 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 3.0530 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 2.6080 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 3.7600 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 4.0440 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 3.1550 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 1.6040 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 1.8740 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.6140 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -2.6700 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -2.1580 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 0.3370 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -1.0620 -3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -1.3160 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5460 1.1650 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 2.7870 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 2.1190 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 6.7280 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 5.7770 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 5.4590 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 4.0100 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 4.4870 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 6.4860 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1820 6.7230 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 4.7310 3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 17 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 11 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 23 25 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 M END > 685 $$$$ 686 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.4780 1.4580 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -0.0640 -0.5500 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5200 -0.6070 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 2.0460 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 1.5790 -1.4830 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8760 0.0600 -1.5590 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8330 -0.3770 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 0.0020 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 2.0420 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 3.1940 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 3.3730 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -0.2900 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 2.2250 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -2.1160 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.4820 -3.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 1.3360 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 1.9090 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.4940 0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 4.5210 1.6300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8090 5.5870 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 4.3420 3.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1350 4.9330 1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 5.6960 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 3.8200 3.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 5.4630 5.6070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.8020 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 1.8020 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.4700 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 3.1360 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 1.7220 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -1.4630 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 0.0920 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -0.7590 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 0.0310 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 2.8810 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 2.4360 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 3.7780 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 4.0610 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 3.3000 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 1.7990 -3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 2.0360 -2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.6140 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.5530 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -2.2460 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 0.5450 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -0.7480 -3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.1530 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 1.2180 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 2.8640 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 2.0570 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.2160 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 6.5320 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 5.7140 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 5.2730 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 3.6500 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 4.3040 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 6.1350 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 6.3600 3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 4.3860 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 28 1 0 0 0 0 3 6 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 16 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 23 25 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 M END > 686 $$$$ 687 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2360 1.4890 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.0040 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.9390 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 1.7540 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 0.9380 1.4340 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1430 -0.5570 1.2570 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7490 -1.3440 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -1.1600 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 1.1480 1.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8220 2.2500 3.3020 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6990 2.8380 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 2.6130 1.3520 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5970 -0.4200 -0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -0.8640 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 1.4380 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.9550 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -2.3530 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 3.0170 4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2600 2.3500 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 0.8030 3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 0.3240 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 3.1090 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 3.0340 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 2.0330 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 1.8100 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 1.4830 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 2.8180 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -1.0300 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -2.4110 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -1.5990 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -1.6550 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 0.7390 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 3.9110 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 2.3590 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 3.1960 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.4210 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 0.7930 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 2.4580 2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -1.3930 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -1.5470 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 0.0650 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -2.3610 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -3.0680 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -2.6290 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 2.9520 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 2.5850 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 4.0630 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 1.8580 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 0.1330 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 4.0460 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 3.5260 5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5890 3.1050 5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 6 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 21 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 12 1 0 0 0 0 9 21 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 22 1 0 0 0 0 12 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 23 2 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 M END > 687 $$$$ 688 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.3510 1.3840 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 0.1010 -1.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.9250 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 1.7850 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 0.8670 -2.4660 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5700 -0.5770 -2.0750 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3940 -1.5390 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -1.3300 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 1.1000 -2.2580 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1690 1.6150 -2.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1860 2.7170 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 2.5180 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -0.6960 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 1.2190 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.2310 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -1.1620 -3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 1.5580 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 2.0160 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 0.3240 -2.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 0.1050 -2.9370 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9530 1.1840 -4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 2.1830 -1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 0.9890 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 0.2460 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 2.8200 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 1.6290 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -2.5730 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -1.3800 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -1.5110 -1.5360 H 0 0 0 0 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evaluation license 3.40 0067 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7000 -0.5320 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 2.0360 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.8370 0.0490 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1060 0.0600 1.3450 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1720 -0.9900 1.6090 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5510 -0.3180 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 1.3980 0.0650 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8850 0.4080 0.4540 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1840 -0.5740 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 0.3850 -1.7000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7760 1.2770 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 2.1700 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 1.2050 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 1.2150 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9030 1.8220 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 2.1650 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -1.6540 2.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 0.7860 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.5060 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -0.4400 -1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.0660 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -0.1220 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.0600 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.9070 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.6020 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 2.6700 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -1.7160 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 0.3900 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -1.0830 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -1.3560 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -1.0230 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 -0.1550 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 1.9080 -3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 0.6550 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 2.6710 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 2.9330 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 2.2170 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 0.6990 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2360 1.7580 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 2.3860 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -2.3360 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.2270 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 0.4520 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -0.9850 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.5430 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -0.4970 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.9650 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.3690 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -2.4660 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.4340 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 19 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 M END > 689 $$$$ 690 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7260 -0.4940 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 2.0430 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 0.8430 0.0420 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1780 0.0030 -1.2230 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1100 -1.2120 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -0.7250 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 1.3440 0.1350 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7920 0.1640 0.0660 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2280 0.7530 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 1.1060 1.5550 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4670 2.3680 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 2.0310 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -0.5850 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 -0.0540 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.0440 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 0.6050 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5000 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.4720 1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -0.0150 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7680 1.2870 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.0230 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0580 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8900 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.8810 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 2.6180 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 2.6750 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -1.7940 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -1.8320 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -1.5850 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -0.1640 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 0.0050 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 1.6420 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 2.7390 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 3.1360 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 2.9490 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 1.3640 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -1.4280 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 -0.3910 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.2270 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -0.8720 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 0.5800 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 2.0960 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7670 1.5320 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 0.3630 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -2.3750 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.3700 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -2.4140 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 1.1470 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.2910 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -0.2900 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 M END > 690 $$$$ 691 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 53 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7210 -0.4940 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 2.0430 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 0.8420 0.0310 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1700 0.0090 -1.2360 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1090 -1.2010 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -0.7090 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 1.3430 0.1180 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7880 0.1610 0.0460 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2270 0.7300 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 1.1770 1.5310 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4700 2.4210 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 2.0390 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 2.0380 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.6180 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5000 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.4720 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -0.0200 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 1.4400 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 0.0210 2.3210 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6950 -0.6370 1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2950 0.0610 2.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.0230 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.0520 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8900 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.8810 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 2.6240 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 2.6690 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -1.7960 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -1.8100 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -1.5660 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -0.1310 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -0.0420 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 1.5810 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 2.8320 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 3.1700 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 2.9390 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 1.3650 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.2260 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 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9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 M END > 691 $$$$ 692 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 -0.1220 1.5300 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.0010 -0.0670 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7280 -0.4930 -1.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3170 2.0430 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 0.8410 0.1830 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1720 -0.0020 -1.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0910 -1.2210 -0.9460 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5340 -0.7390 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 1.3390 0.4020 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6620 0.1580 0.4250 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0950 0.7460 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 1.1100 2.0340 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1920 2.3730 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 2.0340 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 2.0340 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 0.5960 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.4940 -0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.4690 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -0.0140 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4590 1.2940 2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 -0.0450 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -0.5830 1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -2.0390 -2.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.0230 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8940 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.8860 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.0990 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 2.6140 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 2.6780 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -1.7970 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 -1.6020 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -0.1860 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -0.0040 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2110 1.6300 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 2.7510 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 3.1360 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 2.9520 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 1.3710 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -0.2190 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -0.8720 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 0.5840 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 2.0980 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 1.5460 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 0.3690 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -0.3760 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -1.4230 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -2.8300 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.3750 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -2.3680 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.4150 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 6 1 0 0 0 0 3 24 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 M END > 692 $$$$ 693 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.8850 -1.1420 0.8330 C 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 -0.0780 2.2280 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 0.9950 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 1.2970 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 2.6340 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 1.0100 3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -1.9830 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.7310 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -0.2760 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -1.7160 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -3.4950 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 -2.6140 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -6.0850 4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -6.9330 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -5.4970 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -6.6450 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -4.3320 3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -5.7760 2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -0.4450 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 -1.2640 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -2.2200 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 6 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 27 2 0 0 0 0 16 28 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 M END > 693 $$$$ 694 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.0830 1.8950 -4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -1.0590 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.1780 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.3140 -3.7770 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4710 -0.9560 -2.4160 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1370 -2.3550 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -2.2820 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.3600 -4.0800 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9660 -1.7130 -3.9280 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3760 -1.5080 -4.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -0.7670 -5.1010 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1390 0.4930 -5.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 0.2290 -5.4480 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9170 1.4590 -5.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.1730 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -1.3780 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.3320 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -0.9610 -4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 0.3120 -3.3300 H 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 1.8620 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 2.3440 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 2.0980 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 3.6420 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 8.7640 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 5.5350 3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 4.2380 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 5.5810 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 3.9010 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 2.5480 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 3.9440 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 4.9200 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 3.5210 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.4370 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 2.4780 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 4.2560 6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 3.4620 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 2.5660 7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 4.1410 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 1.1370 5.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 2.8150 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 4.1790 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 4.7430 7.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 3.2070 6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 1.1220 4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 2 6 1 0 0 0 0 2 51 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 7 54 1 0 0 0 0 7 55 1 0 0 0 0 7 56 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 57 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 58 1 0 0 0 0 12 59 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 60 1 0 0 0 0 14 17 1 0 0 0 0 14 61 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 63 1 0 0 0 0 15 64 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 65 1 0 0 0 0 18 66 1 0 0 0 0 19 21 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 34 1 0 0 0 0 21 25 1 0 0 0 0 21 35 1 0 0 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-0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 6.2460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 3.6180 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 7.7760 -0.0120 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5310 8.2960 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 8.2520 1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 8.6710 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1180 8.3430 -1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7740 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -1.0100 -1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 8.1360 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7620 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -0.5100 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 1.6470 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 3.9980 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 6.0790 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 6.0700 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6670 5.8840 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 5.8930 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 7.9300 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 9.2570 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0220 8.6840 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -1.7270 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -0.1970 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -1.5010 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 M END > 701 $$$$ 702 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.0370 0.8010 -0.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2390 2.7240 2.2210 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8360 2.1100 2.2580 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4090 1.7460 0.8340 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3620 0.8450 0.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 1.3820 0.1630 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2010 1.7310 1.5610 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1240 1.1220 0.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 0.8430 -0.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9770 -0.5780 -0.8840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6260 -1.3110 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -0.5950 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.6210 0.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9780 1.4020 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 0.0390 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 2.2560 2.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 2.5000 1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 1.2060 2.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -0.3600 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -0.5260 -2.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 3.0560 2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 2.9990 3.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 0.5440 2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 0.3450 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 0.1040 -1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 1.1740 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 3.6490 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 1.2120 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 2.6500 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 2.2810 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 2.1820 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 1.5870 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -1.0680 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.2610 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -2.3480 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 2.6780 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 1.6350 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 3.2770 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 2.8270 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 1.5840 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.2730 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -0.0320 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 0.0920 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -1.4460 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -1.3910 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 2.7340 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 3.6170 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 0.6920 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6290 0.7200 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -0.5850 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -0.5440 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 22 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 30 1 0 0 0 0 7 23 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 M END > 702 $$$$ 703 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 1.7670 -0.0030 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1230 1.3620 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -0.1420 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3650 -0.5300 1.4560 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2130 -2.0090 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.4610 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -1.6930 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.6190 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -0.0320 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 0.0870 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 0.6460 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -0.4150 -0.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 1.2810 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 0.2930 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 2.8080 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.9740 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.9530 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 1.5700 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 2.0210 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.7290 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -0.3130 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -2.4650 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.4400 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -3.5160 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -2.1940 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.0380 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -0.4860 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -0.2290 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 1.0440 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.1730 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -0.1990 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.2780 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 2.2050 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 0.5810 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 1.4970 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -0.1040 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -0.4590 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 1.1860 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 M END > 703 $$$$ 704 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5340 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 1.7830 -0.0030 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0350 1.3870 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.0790 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3520 -0.5080 1.4090 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2960 -2.0400 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -2.5550 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -2.1060 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.5930 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 0.1470 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 0.0430 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 0.7440 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -0.3860 -0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.3220 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 0.3600 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 2.8100 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.9750 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.9440 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 1.6070 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 2.0100 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.7270 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -0.2240 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.4230 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -2.3970 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -3.6500 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -2.1960 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.5540 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -2.3950 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 1.2220 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -0.3150 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.1310 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.2690 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -0.3400 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 2.2310 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 0.5900 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 1.5550 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -0.0700 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -0.3730 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 1.2470 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 M END > 704 $$$$ 705 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.2100 1.4700 0.3430 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1720 -0.0640 0.3470 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8980 -0.6010 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 1.9800 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 1.1800 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -0.2840 0.7250 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3840 -0.5170 1.7450 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6810 0.2330 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 1.3140 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 2.0030 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 3.1930 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 3.2230 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.5600 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -2.0120 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.9280 -0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 1.5990 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -2.4020 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -2.3170 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -0.8760 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.8290 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -0.4430 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -0.1220 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -1.6800 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -0.2710 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 0.6870 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 -0.4930 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 4.0870 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.1690 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -1.6490 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -0.2140 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -2.5820 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 2.8910 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -3.4680 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -2.1850 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -1.8320 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -1.9430 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -3.3940 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -1.8310 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 3 6 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 12 2 0 0 0 0 11 12 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 M END > 705 $$$$ 706 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5370 0.0100 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -0.3670 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 0.7230 -0.0170 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4460 2.0010 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 2.6420 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 2.5200 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 2.0430 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.0310 1.2820 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2120 1.7560 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.9940 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 1.2840 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 0.9100 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -0.3990 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 2.0150 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 1.2740 2.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -0.4000 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -0.3820 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.3050 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -1.3590 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 0.4640 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 2.5960 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 2.5860 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 3.6800 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 2.3320 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 2.8520 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 3.1010 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 1.9920 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.7070 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 2.3930 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 2.5910 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.9610 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 1.4670 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.6390 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 0.2160 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -0.6770 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.2660 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -1.1860 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 2.9470 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 2.1480 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 1.7360 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 0.6180 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 21 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 M END > 706 $$$$ 707 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 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0 0 0 0 38 93 1 0 0 0 0 38 94 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 39 59 1 0 0 0 0 40 41 1 0 0 0 0 40 95 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 47 1 0 0 0 0 42 48 1 0 0 0 0 43 46 1 0 0 0 0 43 96 1 0 0 0 0 44 97 1 0 0 0 0 44 98 1 0 0 0 0 44 99 1 0 0 0 0 45100 1 0 0 0 0 45101 1 0 0 0 0 45102 1 0 0 0 0 46103 1 0 0 0 0 46104 1 0 0 0 0 46105 1 0 0 0 0 47 49 1 0 0 0 0 48 50 1 0 0 0 0 48106 1 0 0 0 0 48107 1 0 0 0 0 49 51 1 0 0 0 0 49108 1 0 0 0 0 49109 1 0 0 0 0 50 51 1 0 0 0 0 50110 1 0 0 0 0 50111 1 0 0 0 0 51 54 1 0 0 0 0 51112 1 0 0 0 0 54113 1 0 0 0 0 54114 1 0 0 0 0 54115 1 0 0 0 0 58116 1 0 0 0 0 M END > 714 $$$$ 715 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 153162 0 0 1 0 0 0 0 0999 V2000 -1.5800 1.4190 -2.5750 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2130 -0.0670 -2.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6810 -0.4140 -1.1420 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5140 0.4870 -0.8220 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1130 1.8560 -0.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 2.2500 -2.1990 C 0 0 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1 0 0 0 0 63149 1 0 0 0 0 63150 1 0 0 0 0 64 66 1 0 0 0 0 65 67 1 0 0 0 0 65151 1 0 0 0 0 65152 1 0 0 0 0 66 68 1 0 0 0 0 66153 1 0 0 0 0 66154 1 0 0 0 0 67 68 1 0 0 0 0 67155 1 0 0 0 0 67156 1 0 0 0 0 68 73 1 0 0 0 0 68157 1 0 0 0 0 73158 1 0 0 0 0 73159 1 0 0 0 0 73160 1 0 0 0 0 74 81 1 0 0 0 0 75 79 1 0 0 0 0 75161 1 0 0 0 0 76 77 1 0 0 0 0 76 83 1 0 0 0 0 76162 1 0 0 0 0 76163 1 0 0 0 0 77164 1 0 0 0 0 78 79 1 0 0 0 0 78 83 1 0 0 0 0 78 84 1 0 0 0 0 78165 1 0 0 0 0 79 80 1 0 0 0 0 79166 1 0 0 0 0 80 81 1 0 0 0 0 80 85 1 0 0 0 0 80167 1 0 0 0 0 81 82 1 0 0 0 0 81168 1 0 0 0 0 82 83 1 0 0 0 0 83169 1 0 0 0 0 84170 1 0 0 0 0 85171 1 0 0 0 0 M END > 718 $$$$ 719 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 194205 0 0 1 0 0 0 0 0999 V2000 0.4020 1.0680 2.5590 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4330 0.5860 3.7480 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4950 -0.0350 4.7950 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2330 -1.1060 4.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -0.7060 3.1140 C 0 0 2 0 0 0 0 0 0 0 0 0 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0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 73 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 74 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 75 1 0 0 0 0 6 7 1 0 0 0 0 7 76 1 0 0 0 0 8 48 1 0 0 0 0 9 77 1 0 0 0 0 10 78 1 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 79 1 0 0 0 0 12 80 1 0 0 0 0 13 14 1 0 0 0 0 13 81 1 0 0 0 0 14 17 1 0 0 0 0 14 82 1 0 0 0 0 14 83 1 0 0 0 0 15 16 1 0 0 0 0 15 84 1 0 0 0 0 15 85 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 86 1 0 0 0 0 18 87 1 0 0 0 0 19 21 1 0 0 0 0 19 88 1 0 0 0 0 19 89 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 67 1 0 0 0 0 21 25 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 41 2 0 0 0 0 23 90 1 0 0 0 0 23 91 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 33 1 0 0 0 0 25 26 1 0 0 0 0 25 66 1 0 0 0 0 26 28 1 0 0 0 0 26 92 1 0 0 0 0 26 93 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 27 69 1 0 0 0 0 28 29 1 0 0 0 0 28 94 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 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0 0 0 0 0 0 0 0 0 0 0 0 4.8370 3.8240 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 5.2970 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4120 2.3650 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7960 4.7480 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 5.1900 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 7.7080 4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 6.6560 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 9.6610 5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 9.4200 5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 10.3960 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8010 8.1380 7.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9740 6.1730 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 7.2240 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1550 7.4950 8.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7440 8.6450 7.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6080 9.6430 9.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1180 6.6340 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 6.6110 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 6.2340 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 7.3770 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 2.5300 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 39 1 0 0 0 0 3 6 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 19 1 0 0 0 0 10 14 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 25 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 22 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 36 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 34 1 0 0 0 0 26 62 1 0 0 0 0 27 35 1 0 0 0 0 27 63 1 0 0 0 0 28 31 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 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1 0 0 0 0 49108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 50111 1 0 0 0 0 50112 1 0 0 0 0 50113 1 0 0 0 0 51 54 2 0 0 0 0 51 55 1 0 0 0 0 52114 1 0 0 0 0 53115 1 0 0 0 0 53116 1 0 0 0 0 53117 1 0 0 0 0 55118 1 0 0 0 0 56119 1 0 0 0 0 M END > 735 $$$$ 736 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 38 37 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.7580 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -0.6960 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -2.1080 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -2.7980 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -4.2630 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -4.7920 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -6.3220 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -6.8520 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -8.3160 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -9.0060 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -10.4190 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -11.1100 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -2.7030 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3290 -8.4120 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3830 -12.8720 0.0030 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.1610 -13.2110 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 2.0960 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -0.1680 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -2.3240 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -4.6140 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -4.6240 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -4.4410 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -4.4310 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -6.6740 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -6.6830 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -6.5000 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 -6.4910 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -8.7900 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -10.9460 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3500 -10.5830 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6060 -12.7780 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6230 -12.7690 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3260 -14.2880 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.6550 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 1.6640 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 3.1740 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 M END > 736 $$$$ 737 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9460 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -1.5920 -1.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.8240 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -2.5710 -3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 -2.8140 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 -3.5610 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 -3.7930 -5.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3730 -4.4390 -6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 -4.6780 -7.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1130 -5.4130 -7.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -0.5570 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0690 -4.8280 -5.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1320 -6.7960 -7.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3380 -7.4700 -7.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5260 -6.7630 -7.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5070 -5.3810 -7.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3000 -4.7060 -7.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -1.9030 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -2.4210 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -0.8680 -3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -1.9740 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9260 -3.5280 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -3.4110 -5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 -1.8570 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -2.9640 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 -4.5170 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -3.4820 -6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 -5.2750 -8.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9100 -3.7210 -8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2040 -7.3480 -7.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3530 -8.5500 -7.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4680 -7.2900 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4350 -4.8280 -7.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2860 -3.6260 -7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 20 1 0 0 0 0 17 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 M END > 737 $$$$ 738 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 93 98 0 0 1 0 0 0 0 0999 V2000 -0.0840 1.4530 -0.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.1210 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -0.5860 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.5100 -0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 3.5610 3.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 4.2560 4.6500 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1620 3.4230 5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 2.6020 4.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 2.3290 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 5.5960 4.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.7780 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 4.8340 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 5.0280 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 4.1630 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 3.1040 -4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 2.9140 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 3.5720 -0.6310 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5620 4.2120 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 3.0490 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 3.0950 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 4.3040 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 5.4660 -2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 5.4200 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 4.1600 -0.0180 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6650 3.1610 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 4.1210 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 4.4440 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 2.5220 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 3.8040 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 2.8480 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 2.1600 1.2190 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0450 4.1310 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 3.2180 1.1300 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1130 1.5790 3.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 1.2940 5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 4.7490 4.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 4.3700 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 0.9200 1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.0670 -0.2510 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9730 4.3520 -6.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 3.4220 -7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 3.9780 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 4.9640 2.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 6.6770 4.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 8.0550 4.2720 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7080 6.5410 4.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 8.1450 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 9.0960 4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 10.5000 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 0.1420 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -1.0970 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -1.3150 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 4.3280 5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 4.0720 5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 2.7620 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 3.1890 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 1.6710 4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 1.4800 3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 2.1460 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 5.7050 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 5.5060 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 5.8530 -4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 2.4300 -4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 2.0900 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 2.1040 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 2.1860 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 4.3400 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 6.4110 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 6.3290 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 5.1610 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 2.9110 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 5.1930 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 2.7350 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 0.9390 5.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 0.5260 5.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 2.2000 5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 4.9460 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 3.3070 5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 4.5680 5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 0.2580 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 1.5330 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 3.4540 -6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 2.4170 -6.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 3.6870 -8.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 8.2460 4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 7.9530 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 9.1410 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 7.4030 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 8.9600 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 8.9740 5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 10.6360 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 10.6220 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 11.2420 4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 54 1 0 0 0 0 7 55 1 0 0 0 0 8 9 1 0 0 0 0 8 56 1 0 0 0 0 8 57 1 0 0 0 0 9 58 1 0 0 0 0 9 59 1 0 0 0 0 10 44 1 0 0 0 0 10 60 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 61 1 0 0 0 0 13 14 1 0 0 0 0 13 62 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 63 1 0 0 0 0 16 64 1 0 0 0 0 17 24 1 0 0 0 0 17 32 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 65 1 0 0 0 0 20 21 1 0 0 0 0 20 66 1 0 0 0 0 21 22 2 0 0 0 0 21 67 1 0 0 0 0 22 23 1 0 0 0 0 22 68 1 0 0 0 0 23 69 1 0 0 0 0 24 33 1 0 0 0 0 24 70 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 25 71 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 27 29 2 0 0 0 0 27 72 1 0 0 0 0 28 30 2 0 0 0 0 28 34 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 31 33 1 0 0 0 0 31 38 1 0 0 0 0 31 39 1 0 0 0 0 33 42 1 0 0 0 0 33 73 1 0 0 0 0 34 35 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 35 76 1 0 0 0 0 36 37 1 0 0 0 0 37 77 1 0 0 0 0 37 78 1 0 0 0 0 37 79 1 0 0 0 0 38 80 1 0 0 0 0 39 81 1 0 0 0 0 40 41 1 0 0 0 0 41 82 1 0 0 0 0 41 83 1 0 0 0 0 41 84 1 0 0 0 0 42 43 2 0 0 0 0 44 45 1 0 0 0 0 44 46 2 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 45 85 1 0 0 0 0 47 86 1 0 0 0 0 47 87 1 0 0 0 0 47 88 1 0 0 0 0 48 49 1 0 0 0 0 48 89 1 0 0 0 0 48 90 1 0 0 0 0 49 91 1 0 0 0 0 49 92 1 0 0 0 0 49 93 1 0 0 0 0 M END > 738 $$$$ 739 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 1.3840 3.7310 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 2.7030 0.0920 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3400 1.4460 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 3.1220 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 1.9480 1.8780 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7160 0.9190 1.3120 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6760 -0.3160 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -0.9850 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 1.3050 1.9520 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1230 -0.0300 2.6930 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5370 1.6690 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 2.2800 2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 0.3660 3.0730 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5110 -0.6140 2.4890 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8480 -1.8780 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4000 -1.9260 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8540 -0.4530 2.9940 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7930 -0.9010 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.7090 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 3.2790 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 0.3800 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 2.5090 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 0.1340 4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -0.0620 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1400 0.5060 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 -0.2160 5.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1360 -0.6380 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4930 -0.0660 3.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 13.6650 -1.0400 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0200 -0.4500 1.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0610 -0.5340 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3990 -2.5200 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.5750 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 1.1110 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 0.5620 4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 4.5800 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 4.1140 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 2.4190 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 2.7500 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 3.8750 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -0.0590 3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -1.0330 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.8890 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -1.2510 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 1.5280 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 2.3610 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 3.1980 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 2.5170 3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -1.7850 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -2.7560 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 -2.3440 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -2.5200 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 -0.3070 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 0.0250 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -1.3180 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -1.6160 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 1.8700 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 0.8500 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 2.5950 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 4.0640 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 0.1900 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.5430 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 0.7450 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 3.1860 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 1.6910 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 3.0530 3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -0.8040 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.9210 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 0.4030 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0870 1.1070 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4700 1.1300 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0620 0.0640 6.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 -0.6230 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2440 -1.1960 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -1.3030 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7100 0.9410 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0710 -0.2250 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7880 -1.3320 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3180 0.3160 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6370 -2.8890 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3190 -3.0880 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0510 -2.6390 4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 10 14 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 24 1 0 0 0 0 17 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 27 28 1 0 0 0 0 27 74 1 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 76 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 31 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 M END > 739 $$$$ 740 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 43 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9460 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -1.5920 -1.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.8240 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -2.5710 -3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 -2.8140 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 -3.5610 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 -3.7930 -5.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3730 -4.4390 -6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7710 -4.6630 -7.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9280 -5.3100 -7.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -0.5570 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0720 -4.8290 -5.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4250 -5.5900 -9.4990 S 0 0 0 0 0 0 0 0 0 0 0 0 13.9860 -6.4620 -9.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -1.9030 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -2.4210 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -0.8680 -3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -1.9740 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9260 -3.5280 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -3.4110 -5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 -1.8570 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -2.9640 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 -4.5170 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -3.4820 -6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1510 -4.3170 -8.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5480 -5.6560 -7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6650 -5.8220 -8.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7960 -7.3750 -8.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4370 -6.7160 -10.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END > 740 $$$$ 741 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 67 72 0 0 1 0 0 0 0 0999 V2000 0.2570 1.7780 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.4320 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -0.0880 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 0.7380 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 2.0840 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 2.6040 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 3.3720 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 5.8460 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 4.5290 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 5.7720 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 6.7440 4.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 6.0880 5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 4.7200 4.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 4.6860 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 3.4410 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 2.4370 1.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 4.4510 1.0440 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3390 2.9420 1.2550 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1350 2.3440 -0.1480 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3250 3.4960 -1.1560 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2030 4.5220 -0.3980 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8900 7.0580 2.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 7.6280 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 5.2990 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 4.1340 -0.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 2.7120 2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 3.4050 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 3.1960 2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 2.2910 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 1.5980 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.8140 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 3.0040 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 2.0250 -2.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 3.6520 -3.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 3.2400 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 4.7670 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 2.0840 4.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 1.1380 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.2130 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.1390 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 0.3320 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 2.7300 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.6560 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 2.4090 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 6.1550 6.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 6.5180 5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 1.5630 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 3.9360 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 5.5220 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 6.9600 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 7.7670 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 8.5920 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 6.2430 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 4.0870 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 4.1090 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 3.7370 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 0.8920 4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 1.2740 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 3.3370 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 3.8750 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 2.2020 -4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 4.3980 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 5.5070 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 5.2280 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.0680 6.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 1.4620 6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.1610 5.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 43 1 0 0 0 0 7 9 1 0 0 0 0 7 15 2 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 48 1 0 0 0 0 21 25 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 37 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 M END > 741 $$$$ 742 MOE2008 3D CORINA evaluation license 3.40 0067 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 0.0910 1.0280 0.2520 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0100 -0.8860 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 1.6490 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 1.2590 1.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4070 -0.2640 1.5000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2020 -0.6570 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -0.0260 2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.8830 1.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4600 1.4960 2.6280 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9460 4.0690 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 3.3960 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 1.7680 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 1.8520 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 1.8540 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -0.9730 -0.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.4960 0.3230 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6520 1.3920 -0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 1.4830 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -0.6280 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 4.0440 3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 3.6820 2.5600 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8270 2.1450 2.5260 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7650 1.9360 3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 3.1200 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 4.2190 2.8430 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9360 5.4980 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3480 6.0570 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5130 4.4130 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 3.1750 4.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.3920 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.9720 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.5230 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 1.2840 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.7340 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -0.3030 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 -1.7420 2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -0.3070 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -0.3790 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980