PUBCHEM-ZINC02549350 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 -0.0650 1.3870 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.0010 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.7220 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.1330 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -2.7500 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -1.9800 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -0.6310 -0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -0.0050 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.3920 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.0880 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 2.3380 -0.3570 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -1.8210 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3770 -2.3440 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -3.6140 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 -4.3610 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 -3.8320 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 -4.3270 0.2080 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -3.0300 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -2.6520 0.7840 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0150 1.9090 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -0.5240 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -3.8320 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.1710 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -0.8240 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1680 -1.7490 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -5.3520 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -4.4340 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -4.1150 -0.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 19 20 1 0 0 0 0 19 29 2 0 0 0 0 M CHG 1 20 -1 M END