CHEMDIV-ZINC04732711 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.1200 1.4730 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0560 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.5270 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.9780 -1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -2.5570 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -1.8680 -3.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -4.0260 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -4.6280 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -5.9940 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -6.7820 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -6.1860 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -4.8190 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -8.1670 -2.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -9.0420 -1.3020 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -8.6260 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -10.3930 -1.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -8.5250 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -7.5940 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -7.3540 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -8.0920 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -9.1640 -1.7580 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 -8.0030 -0.9380 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 1.8750 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.8240 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.8080 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.4080 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.4580 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.1760 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -0.1240 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -4.0180 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -6.4600 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -6.7990 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -4.3570 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -8.6220 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -7.0660 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 -6.6260 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END