CHEMBRIDGE-ZINC00454683 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3810 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 1.2020 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1700 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 1.5770 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 3.5180 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 4.2080 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 3.6140 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 5.6700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 6.3610 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 7.8320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 8.5520 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 9.9300 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 10.6020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 9.8960 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 8.5180 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 12.4930 0.0130 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -0.6560 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 3.9910 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 6.1970 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 5.8340 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 8.0280 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 10.4860 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 10.4270 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 7.9690 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -0.8460 -0.9220 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 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 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 M END