PUBCHEM-ZINC05514822 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.1250 1.4270 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.5720 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.1310 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 0.0040 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 0.8830 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 1.5820 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 1.1090 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 0.5420 -1.4370 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4360 -0.7260 0.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -1.7850 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -2.4900 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -3.8780 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -4.5750 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 -3.9010 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -2.5170 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -1.8090 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 -0.4680 -0.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -6.4530 0.3870 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 1.9810 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 0.4540 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.7940 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 2.2630 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -2.1810 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -4.4040 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2170 -4.4400 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 -1.9860 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 -0.0740 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 1.8570 -2.6080 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 28 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 23 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 24 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 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 27 1 0 0 0 0 M CHG 1 8 -1 M END