COMGENEX-ZINC04589850 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0230 1.4760 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.0310 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.7240 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.1060 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.7950 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.1020 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.7200 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.5570 -0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -4.9530 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9560 1.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -5.0590 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -4.7690 -1.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0180 -3.8890 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -5.9660 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -6.1530 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -6.9630 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -7.1340 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -6.4960 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -5.6860 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -5.5180 -3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -4.5060 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -4.5570 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -4.2150 -1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0880 -4.0860 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 -4.7280 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8010 -4.5980 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6990 -3.8290 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2950 -3.1890 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9910 -3.3100 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5500 -2.6060 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.8460 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8370 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.8350 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.1850 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.6470 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.6410 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.1790 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -5.5460 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -6.8640 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -5.7870 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -7.4620 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -7.7660 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -6.6290 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -5.1870 -5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -4.8890 -4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -4.0960 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -5.3280 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1200 -5.0970 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -3.7290 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9990 -2.5900 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7110 -3.2600 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -1.6910 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -2.3590 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 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 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 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 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 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 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 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 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 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