IBS-ZINC04834761 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0740 1.4290 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0400 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.6100 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 0.1550 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 1.5660 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 2.1890 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 4.0710 0.3630 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -0.5550 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -1.9590 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -2.6360 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -1.9490 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -4.1680 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -4.7560 -0.3180 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0110 0.1240 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 1.1540 -0.7630 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0540 1.8930 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -0.5590 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 2.1800 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -2.5170 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -4.7640 -0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -0.3950 0.6950 O 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 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 14 15 1 0 0 0 0 14 21 2 0 0 0 0 M CHG 1 13 -1 M CHG 1 15 -1 M END