PUBCHEM-ZINC04614387 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.3810 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6780 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0260 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4080 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.0850 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.1760 -0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3820 1.6890 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 2.2120 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.8820 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 2.9280 3.1810 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 3.5110 -0.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.6990 -0.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7010 -1.9150 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -0.0790 -0.1900 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9100 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7580 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1650 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 2.7770 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 1.1940 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 2.3170 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 3.9000 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 4.0060 0.0780 H 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END