CHEMBRIDGE-ZINC01781479 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.0470 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 0.9850 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -0.4060 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 0.3160 -4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -0.0530 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -1.1560 -6.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 -1.2170 -7.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -0.1850 -8.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5630 0.9120 -7.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0950 0.9920 -6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 1.9660 -5.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 1.6300 -4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 2.2890 -3.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -2.7100 -8.9130 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -1.9790 -3.6910 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -2.0580 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -2.9570 -1.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -1.9590 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 -0.2400 -9.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1680 1.7090 -7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 2.7860 -5.3860 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 26 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 20 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END