IBS-ZINC02211173 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 0 0 0 0 0 0999 V2000 1.3720 1.4450 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 0.1230 -0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -0.5220 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -1.7180 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -1.8330 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.6720 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.3590 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 0.7610 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 1.6560 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 1.4930 -0.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 2.6780 -2.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 2.8030 -3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 3.6810 -4.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 1.4340 -4.3140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 1.3320 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 1.9740 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 2.0140 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -0.1440 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.4530 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -2.6680 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.0090 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 3.3280 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M END