PUBCHEM-ZINC02584155 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -1.6950 -1.5400 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.4810 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -2.2660 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -2.8830 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -3.7200 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -3.9450 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -3.3220 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -3.5530 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -3.0150 -3.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1270 -4.5560 -0.5240 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -1.4720 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -0.0820 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -1.6170 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -2.7130 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 -4.5970 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -4.3620 -4.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -4.4830 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 22 23 1 0 0 0 0 M END