PUBCHEM-ZINC05625293 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 1 0 0 0 0 0999 V2000 -0.1120 1.6250 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.1010 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.3350 1.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3040 0.4680 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -1.3890 0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.0720 -0.2840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5980 -2.8060 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.6220 -1.3950 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 0.2330 -1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -2.6780 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -1.9560 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -1.8390 2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -4.6130 0.2210 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -2.1000 -1.0420 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -0.7040 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.9350 2.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -0.4750 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 2.0580 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.9200 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 2.0830 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -0.2210 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -1.5670 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.0710 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.2850 3.1540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 M CHG 1 24 -1 M END