PUBCHEM-ZINC04647274 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0320 1.4560 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0720 -0.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4580 -0.4620 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.5340 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -2.0490 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.7140 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -4.1100 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -5.2420 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -6.4440 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -6.5170 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -5.4030 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -4.1870 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -2.9530 -0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0760 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -0.5940 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -7.6100 1.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -8.6430 2.5780 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -8.9250 2.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -9.6520 2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -7.7480 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -7.1370 4.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -6.4340 5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -6.3430 6.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -6.9540 6.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -7.6610 5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -5.3820 7.9980 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.8280 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.7850 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.8460 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -0.0240 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.2990 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.2700 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.4140 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -5.1850 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -7.4750 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -5.4750 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.0790 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -0.4210 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -7.8140 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -7.2080 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -5.9570 5.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -6.8830 6.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -8.1420 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END