PUBCHEM-ZINC00983827 MOE2007 3D CORINA 3.40 0006 02.08.2006 15 16 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3510 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.7190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -0.0890 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 1.3270 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.0740 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 3.3760 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 3.6230 -0.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 2.1550 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -0.8800 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1580 -1.2010 -1.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -1.2110 1.0120 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1490 -2.6090 -0.0230 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8790 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.5440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END