CHEMBRIDGE-ZINC03898121 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3790 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0050 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -0.6510 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.1220 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.4370 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0730 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.1270 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -2.7900 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -2.7370 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -4.1310 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -4.9250 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -6.3000 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -6.8870 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -6.1000 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -4.7230 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -3.6470 1.5330 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -8.3620 0.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9780 -9.0560 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -8.8800 0.9580 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9110 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5720 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -0.3620 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.1530 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 -2.2100 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -4.4680 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -6.9180 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -6.5610 1.3720 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END