IBS-ZINC05030066 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.8220 1.2270 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0090 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -0.3090 1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -1.5300 1.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -1.7940 2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.9740 3.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -3.0820 2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -3.3690 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -4.5880 4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -5.4760 3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -5.1790 2.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -4.0290 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.8780 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.4610 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -2.2720 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -2.5090 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.9340 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -1.1160 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -2.2650 -4.5820 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 0.9770 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 1.6150 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.9830 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -2.1840 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -2.6570 4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -4.8440 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -6.4280 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -3.8200 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -1.2780 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -2.7240 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -3.1450 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -0.6640 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 31 1 0 0 0 0 M END