PUBCHEM-ZINC02740944 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.5770 0.8090 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.5020 -0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.6770 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 0.3330 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 0.0410 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -1.2550 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -2.2710 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.9920 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -2.9620 -0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.3170 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -4.9130 0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -5.0040 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -6.3890 0.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -7.1100 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -6.5660 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -7.3780 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -8.7450 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -9.3040 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -8.4910 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -9.1460 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -8.9010 2.0500 O 0 5 0 0 0 0 0 0 0 0 0 0 5.7070 -9.8440 -0.3570 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 0.7740 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 1.1390 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 1.5180 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 1.3560 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 0.8280 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -1.4800 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -3.2680 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -2.5780 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -4.8510 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -4.5000 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -5.5070 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -6.9330 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -10.3730 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -9.9540 0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 2 0 0 0 0 M CHG 1 21 -1 M END