CHEMBRIDGE-ZINC02822413 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.0160 -3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.3860 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.7020 -4.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 2.1760 -5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 3.5860 -5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 4.4830 -5.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 5.7850 -5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 6.7100 -4.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 8.0340 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 8.4360 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 7.5150 -4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 6.1920 -4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 10.2480 -4.1240 Br 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 1.3590 -2.3720 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.3060 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.4690 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -0.9810 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 0.7360 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 0.3720 -5.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.3170 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 2.1980 -6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 1.5100 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 3.9120 -6.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 3.5800 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 6.3960 -5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 8.7540 -4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 7.8320 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 5.4740 -4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1130 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -0.7560 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 39 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 39 40 1 0 0 0 0 M END