IBS-ZINC05347314 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.4420 1.0710 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 1.0160 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 3.0190 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 3.4760 2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 4.9400 2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 5.5880 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 6.9870 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 8.0820 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 9.2360 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 8.9330 4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 7.6030 4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 6.8280 5.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 5.5160 5.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 4.8980 4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 10.6010 2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 11.5530 2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 12.8270 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 13.1650 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 12.2220 1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 10.9480 2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 14.4220 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 14.7040 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 7.9610 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 8.3580 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 8.2450 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 7.7350 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 7.3390 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 7.4550 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 7.6240 -2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 7.0920 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.0190 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 1.4520 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 1.4240 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 1.3380 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.0730 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 1.3870 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 3.3920 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 3.4080 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 3.0860 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 3.1030 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 5.4550 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 4.9210 6.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 11.2900 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 13.5630 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 12.4900 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 10.2160 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 15.7390 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 14.5460 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 14.0400 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 8.7540 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 8.5520 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 6.9430 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 7.1500 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 7.7280 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 6.0860 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 7.0580 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 1.5510 1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 57 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 42 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 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END