IBS-ZINC02278041 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.8690 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -1.3480 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -1.4840 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -1.1420 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.6560 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -0.3050 -2.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.4430 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 0.0060 -4.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4740 -0.6130 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -0.1380 -6.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 0.1780 -7.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -0.7410 -7.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -2.1110 -7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -2.7940 -8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.1270 -9.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.7700 -9.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.0690 -8.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.3470 -8.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 1.4380 -7.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 2.6740 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 3.7910 -8.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 3.6990 -9.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 2.4850 -9.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 5.2450 -10.2440 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -3.0830 -10.7110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.3740 -4.6260 O 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 0.5120 -0.3560 -0.8950 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 -1.4690 -0.7640 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -1.6160 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -1.8590 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -1.2490 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.0310 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -1.4860 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 0.1760 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -1.1620 -6.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 0.5480 -6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.6400 -6.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -3.8570 -8.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.2520 -10.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 2.7560 -6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 4.7470 -7.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 2.4150 -10.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 1.9840 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 22 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 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 49 1 0 0 0 0 29 50 1 0 0 0 0 M END