COMGENEX-ZINC04977789 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.7640 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.1900 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -1.1710 -2.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.7320 -1.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -0.5740 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -0.8100 -0.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -0.6040 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -0.1690 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -0.0170 1.2780 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -0.8360 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 -1.2870 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4620 -1.5020 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 -1.2710 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5990 -0.8240 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -0.6000 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6990 -1.5080 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.6360 -2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -0.2560 -1.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -0.9400 -4.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -0.8130 -4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -1.2160 -5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 -1.0830 -6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -1.4870 -7.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 -1.3540 -7.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 -1.7580 -9.4240 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -1.4820 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 0.0520 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 -1.4680 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 -1.8510 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1880 -0.6450 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -0.2460 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2090 -0.5930 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0330 -1.8000 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 -2.3040 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -1.2430 -4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 -1.4640 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 0.2210 -4.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -0.5650 -6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -2.2500 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 -1.7350 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -0.0500 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -0.8360 -8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -2.5200 -7.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -2.0060 -7.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -0.3200 -7.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -1.1060 -10.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -2.7910 -9.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5610 -0.6960 -9.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 -1.6300 -9.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4020 -1.8910 -10.7140 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 32 1 0 0 0 0 2 33 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 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 34 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 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 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 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 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 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 25 1 0 0 0 0 24 46 1 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 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 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 54 1 0 0 0 0 28 55 1 0 0 0 0 28 57 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 M END