CHEMBRIDGE-ZINC00943083 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.8070 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5590 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3520 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -2.6590 -3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -3.1450 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -3.2410 -4.1030 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -2.6150 -2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -2.4040 -1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -2.6970 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -3.1460 -2.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -2.4670 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -2.8520 -0.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2550 -2.7070 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9660 -2.2040 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9740 -2.0580 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2720 -2.4120 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5640 -2.9120 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 -3.0660 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9550 -3.7580 -2.0540 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -3.5540 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -3.7190 -6.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6390 -4.5980 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.4730 -5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.4550 -3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -3.8850 -7.5580 C 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 3.3580 -2.0440 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -1.4110 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -3.0630 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -1.9280 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7490 -1.6670 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0590 -2.2960 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5780 -3.1870 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.7830 -6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.4990 -6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.5800 -5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -2.4980 -5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -3.2580 -3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -1.4950 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -4.7680 -7.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -4.0030 -7.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -3.0040 -8.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END