PUBCHEM-ZINC05562012 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.2430 1.4930 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.0070 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.6640 1.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -2.0620 1.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -2.9080 2.5080 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -4.2640 2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -2.4880 3.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -2.3600 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.9960 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -2.5670 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 -1.5010 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -0.8650 4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -1.2980 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -0.9130 5.5250 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.6820 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -0.3730 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -1.1680 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -2.1140 -3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -2.0410 -1.4570 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 1.6820 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.9600 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.9120 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -2.5350 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -3.8280 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -3.0640 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -0.0320 5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -0.8040 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 0.4280 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -1.0360 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.8220 -3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 M END