CHEMBRIDGE-ZINC00687657 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.6660 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -4.0470 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -4.5600 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -3.7020 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.3290 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.4870 -3.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -1.0730 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -4.3990 -4.1560 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -4.9640 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -6.2530 0.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -6.9540 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -8.3560 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -8.8920 2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -8.0770 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -6.7080 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -6.1390 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -4.4560 1.9250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -2.2650 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -5.6280 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -1.9470 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -0.4050 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -0.5490 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -9.0060 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -9.9660 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -8.5170 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -6.0740 4.2520 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 M END