PUBCHEM-ZINC00435194 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.2080 1.3330 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.1310 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.9520 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7270 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -1.7950 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -3.0950 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -3.3370 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.2680 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.1760 -0.7800 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1580 -0.8870 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -0.3720 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 0.4990 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 0.9770 -4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 0.5960 -5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.2650 -4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -0.7580 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.6090 -3.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 2.1560 -4.6750 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -3.3030 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 1.6580 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.7360 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.6940 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.2810 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -1.6200 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -3.9240 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -4.3510 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 0.7980 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 0.9750 -6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.5570 -5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -1.1700 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -3.5970 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -3.0070 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -4.1440 -1.2770 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 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 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 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M CHG 1 9 1 M END