IBS-ZINC05450826 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.9500 3.6430 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 2.3490 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.3040 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.5500 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 2.8510 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 3.8970 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 3.1040 -0.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 3.7230 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 3.8180 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 4.5150 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 4.0360 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 3.9320 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 5.5640 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 5.9440 -0.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 6.2480 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 7.5570 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 7.8190 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5950 8.9670 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 8.9080 5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 7.7180 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 6.5770 4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 6.6120 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 5.6650 2.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 4.7390 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 10.4590 6.0210 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 0.5290 -0.4120 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 4.4560 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 2.1540 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 0.2940 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 4.9080 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 3.1140 -2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 4.7220 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 2.8160 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 4.3780 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 3.0550 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 4.7400 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.9280 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 3.4750 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 8.2700 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 9.8960 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 7.6880 6.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 5.6570 5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 M END