PUBCHEM-ZINC04599863 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.5200 2.3100 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.9960 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -0.0560 0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 0.2040 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 1.5260 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 2.5720 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.8880 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 2.0810 -1.6810 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 2.5100 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9740 2.6820 -2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 1.7230 -3.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 3.9820 -3.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9170 4.5280 -4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1500 3.7770 -5.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 4.3780 -6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 5.7310 -6.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8050 6.4900 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 5.9050 -4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0120 6.7460 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4840 6.1350 -2.1210 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4750 -1.3020 0.1860 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 3.1360 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 0.7900 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.0780 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 3.6090 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 2.8340 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 1.1450 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 3.4210 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 1.7020 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 4.7170 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 2.7220 -5.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 3.7860 -7.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 6.1970 -7.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 7.5470 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 7.9680 -3.1510 O 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 22 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 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 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 2 0 0 0 0 M CHG 1 20 -1 M END