IBS-ZINC02208191 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2130 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.0470 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4370 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 3.9890 0.0130 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -0.9430 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -0.7080 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -1.9680 -0.0640 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -2.6340 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -2.6190 -1.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 -1.3670 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -2.2720 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -3.3570 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.0490 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9980 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 -2.0240 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.7490 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 21 1 0 0 0 0 M END