IBS-ZINC02252230 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 1 0 0 0 0 0999 V2000 -0.2280 1.5430 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.0370 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -0.6440 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -2.0250 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.7250 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.0440 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -0.6630 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.2300 -0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3740 -4.5880 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -4.8330 -0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0480 -4.1180 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -6.0630 -1.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5900 -6.0230 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -7.2320 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -8.3980 -0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -6.7780 0.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -5.4310 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -4.8030 1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -7.6280 1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -8.3490 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -9.1860 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -9.3060 3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -8.5880 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -7.7540 3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -10.4510 5.1450 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -4.8530 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -6.2810 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -6.8930 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 1.9480 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.8780 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 1.8920 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.0970 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.5570 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.5910 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.1310 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -8.2560 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -9.7470 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -8.6830 4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -7.1980 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -4.1210 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -4.7120 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -6.8400 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -6.2490 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -7.9360 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -6.8080 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -6.0900 -1.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -4.7240 -1.1070 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 46 47 1 0 0 0 0 M END