PUBCHEM-ZINC03078559 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.0030 1.3540 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.0640 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -0.6530 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 0.1210 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.4720 -3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -1.8540 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -2.6330 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -2.0340 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.7890 -0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -4.1980 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -2.4900 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -3.6940 -4.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.7380 -5.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -2.3510 -6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -1.7210 -7.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -2.3260 -8.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -3.5630 -8.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 -4.1940 -7.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -3.5860 -6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -5.8800 -6.9280 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -4.1580 -9.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.6140 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 1.8340 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.6950 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.1900 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 0.1330 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -3.7020 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -4.6800 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -4.3870 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -4.5990 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.7710 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -0.7580 -7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -1.8360 -9.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -4.0750 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 -3.9300 -9.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 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 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 21 35 1 0 0 0 0 M END