COMGENEX-ZINC06801954 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 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 -2.0030 -1.3540 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.9710 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -2.6800 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -2.6130 -1.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -1.5950 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -0.9440 0.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.3030 0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -0.9290 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -0.9130 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -0.8980 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0030 -0.8990 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 -0.9150 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -0.9240 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -3.4070 -4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -3.3940 -4.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -4.0900 -4.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -4.8160 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 -5.5010 -6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -6.2270 -7.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 -6.9100 -7.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8580 -6.9240 -7.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -7.6580 -9.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -8.4140 -9.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -9.1860 -9.0770 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -1.8820 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -0.9140 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 -0.8860 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9130 -0.8870 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0270 -0.9160 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -0.9310 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -4.1000 -4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -4.1180 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -5.5690 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -6.2000 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -4.7480 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -6.2170 -7.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -7.1960 -9.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 -8.3710 -8.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -8.4500 -10.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -9.7310 -9.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 -9.6520 -8.0970 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 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 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 5 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 36 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 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 37 1 0 0 0 0 14 15 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 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 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 22 46 1 0 0 0 0 23 24 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 26 27 1 0 0 0 0 26 28 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 51 1 0 0 0 0 28 52 1 0 0 0 0 M END