IBS-ZINC02245665 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.0510 1.6070 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.1200 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -0.3810 -0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -1.6860 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -2.3800 0.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -2.2670 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -3.6020 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -4.1640 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -3.4770 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -4.3400 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -5.6310 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -5.5830 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -6.7530 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -7.9570 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -8.0050 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7980 -6.8560 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0280 -3.9550 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -1.4450 -0.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -0.4170 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -0.1430 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 0.3780 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 1.4450 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 2.1840 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 1.8690 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 0.8090 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 0.0690 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8570 2.5990 -0.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5940 2.2220 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 1.9890 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 1.7390 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 2.1530 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4270 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.0120 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -4.2500 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -2.4090 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -6.7180 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -8.8660 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -8.9540 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 -6.9050 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 -3.7320 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6110 -4.7750 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 -3.0720 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -1.6180 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 1.6890 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 3.0080 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 0.5670 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -0.7520 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 2.8850 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9520 2.2990 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9410 1.1940 -2.0460 H 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END