COMGENEX-ZINC06870586 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0260 1.5030 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0100 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4880 -0.4940 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5260 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -0.8220 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -0.6600 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -1.0630 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -0.0710 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 0.0390 -2.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 0.5540 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.4000 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.3080 1.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.1450 1.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8160 -0.5720 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -1.6210 2.9490 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.2090 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 0.1750 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 0.8820 2.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.3620 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -2.9940 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -4.0920 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.3520 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -3.1710 0.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.8920 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.7180 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.9760 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -2.0670 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -1.0470 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -0.4280 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.9050 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 0.6480 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 1.5330 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 0.0550 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -1.3360 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -0.5230 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 0.6150 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -2.6740 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -4.6930 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -5.1650 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 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 4 1 0 0 0 0 2 12 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 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 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 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 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 15 1 0 0 0 0 13 19 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 17 18 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 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 39 1 0 0 0 0 M END