PUBCHEM-ZINC06855190 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.1380 1.5060 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0170 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.5650 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 0.0270 -1.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6270 -0.3340 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 1.5680 -1.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6340 1.9020 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 2.1090 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 2.0870 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 4.1340 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 5.6410 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 6.3480 -1.7480 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -0.4220 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -1.3950 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 1.8470 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 1.8700 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.3630 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -0.4120 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -1.6560 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.3400 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.1980 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 1.8970 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 1.8870 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.6490 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4650 3.6470 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 3.8570 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 5.9250 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 6.1350 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 3.5750 -1.3770 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0590 3.8110 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 4.0270 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 13 14 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M END