IBS-ZINC02252803 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.2380 1.4430 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.0620 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -0.6590 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.0660 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.8070 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1430 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -2.7860 0.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.7980 0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -0.1180 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 0.0900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 0.7900 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 2.1700 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 2.8130 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9130 2.0740 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 0.6930 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 0.0510 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.3100 0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7450 -4.7080 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -4.7950 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -3.9590 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -2.6660 -0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -4.4470 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -6.1360 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -6.5070 -1.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -7.0160 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -8.3660 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -4.7890 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -5.6150 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -6.0310 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -5.6130 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -4.8280 3.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -4.4170 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 1.8640 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 1.7580 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 1.7940 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.0610 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -0.7260 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 0.8500 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 0.6980 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -0.8780 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 2.7480 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 3.8920 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 2.5760 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 0.1160 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -1.0280 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -5.3520 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -3.8890 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -8.9660 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -8.7700 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -8.3900 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -5.9250 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -6.6740 3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -5.9330 5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -3.7780 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 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 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 M END