CHEMBRIDGE-ZINC05016053 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.1150 1.3520 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 0.0540 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.9310 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -1.7530 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -2.9200 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -3.4050 -0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -3.5590 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -2.4280 -3.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0790 -1.9720 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -1.4350 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -0.4930 -2.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -3.0330 -3.8640 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -1.7330 -5.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -1.6450 -5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -0.5490 -6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 0.3950 -6.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 0.2110 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -0.8210 -5.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -2.6470 -5.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -3.8680 -5.7520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7280 2.0210 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 1.7680 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -0.3270 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -1.5620 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -0.4200 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -3.9240 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -4.4020 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -0.4440 -7.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 1.2420 -7.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 0.9130 -6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -2.1820 -5.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 21 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 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 10 1 0 0 0 0 5 6 2 0 0 0 0 5 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 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 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 19 1 0 0 0 0 15 16 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 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 2 0 0 0 0 M CHG 1 20 -1 M END