IBS-ZINC05026521 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0040 1.1660 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 1.8840 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 2.4560 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 2.6800 -3.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 2.7230 -2.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 2.4800 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 2.7430 -0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 1.9620 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 1.6400 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 1.1660 1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 1.7360 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 3.2920 -3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.6680 -2.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 1.4510 -2.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6390 0.6900 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 0.9850 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.3630 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -1.5580 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.5580 -4.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.5070 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.0170 -4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -0.6190 -4.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 0.2000 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -0.3630 -5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -1.7420 -5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -2.5680 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 2.7400 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 3.7370 -1.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 2.7800 -2.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 4.0550 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 0.2090 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 1.0660 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.9190 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 2.0450 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 0.6760 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 2.3170 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 2.4860 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 3.9150 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 3.8980 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.8710 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 1.7040 -4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 0.9100 -3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -1.7080 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.2740 -4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 0.2710 -5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -2.1710 -5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -3.6400 -5.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 4.8010 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 4.3720 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 3.9490 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END