IBS-ZINC05443440 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 0 0 0 0 0 0999 V2000 -0.1570 1.0790 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.0890 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.5400 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 3.4730 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 3.0220 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 3.4830 4.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 4.9830 5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 5.7860 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 7.1730 4.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 7.7570 5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 6.9610 5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 5.5600 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 5.0100 6.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 5.9540 6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 5.7260 7.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 4.3540 7.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 3.2700 7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 1.9840 7.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 1.7570 8.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 2.8330 8.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 4.1250 8.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 2.3460 9.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 0.9540 9.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 0.6010 8.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 7.2680 6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 8.3670 6.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 5.2150 3.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.0110 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.4540 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 1.4400 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.5100 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0010 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 1.0970 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 1.2180 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 4.5610 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 3.0520 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 3.3440 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 3.4650 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 3.0330 5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 3.2020 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 7.7890 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 8.8330 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 6.5540 7.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 3.4420 6.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 1.1490 7.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 4.9570 9.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 0.8210 8.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 0.3620 10.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 5.0430 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 1.5570 1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 3.0050 3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 50 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 51 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 51 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 27 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 25 26 2 0 0 0 0 27 49 1 0 0 0 0 M END