CHEMBRIDGE-ZINC00674497 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0720 1.5010 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.0050 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7010 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.0800 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.7740 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.0680 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.6870 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.2730 -2.8280 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.2520 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -4.8660 1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.9200 -1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -6.3140 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -7.0710 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -8.4470 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -9.0710 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -8.3210 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -6.9440 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -6.2120 -3.2220 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -9.2540 0.8820 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4790 -8.7060 1.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -10.4670 0.8710 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9480 1.8870 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.8590 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 1.8480 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.1630 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.6220 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.5990 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -4.4340 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -6.5850 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -10.1470 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -8.8120 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END