PUBCHEM-ZINC02821355 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.2100 1.0680 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 0.2230 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -0.3450 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -0.0590 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 0.7790 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 1.3430 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.6720 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 0.0400 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -0.5540 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 0.0880 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -0.8630 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0270 -1.0970 -0.6840 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4050 1.4620 0.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 2.1960 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 1.7370 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 3.6200 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1710 4.6920 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3680 5.8590 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 5.4210 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 4.0740 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 6.5330 0.8930 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 1.5100 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 0.0060 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.9990 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 0.9960 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.9950 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -1.7390 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 1.1090 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -1.6380 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 2.0090 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2490 4.6270 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 6.8810 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8470 -1.3400 1.5920 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 2 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 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 12 -1 M END