PUBCHEM-ZINC03756631 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.3870 1.5080 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.0390 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.5720 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.9300 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -2.6860 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -2.1050 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.7280 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -2.8830 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.2420 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.9150 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -4.1830 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -4.7620 -6.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -4.0030 -7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.6430 -7.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.0580 -5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -2.7950 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -2.1790 -3.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -0.1790 -5.7930 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -6.3970 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -6.8780 -4.6040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5280 2.0680 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 1.7290 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 1.8580 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 0.0040 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -2.4050 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -3.7380 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -0.2420 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -4.8050 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -5.8290 -6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -4.4790 -8.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.0480 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -7.0430 -2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 19 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 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 19 20 1 0 0 0 0 19 32 2 0 0 0 0 M CHG 1 20 -1 M END