IBS-ZINC02227590 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 1.1910 -4.4320 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -3.3740 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -3.4810 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -2.4230 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -2.4990 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -2.1050 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -2.9390 -2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -0.8250 -1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.4670 -3.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7260 -1.0850 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -0.7010 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 0.9860 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 1.3820 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 2.7150 -3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 3.6510 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 3.2540 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 1.9210 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -3.9070 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -4.5300 -0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -4.4750 1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -5.8440 1.7540 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2550 -6.0210 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -6.8330 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -6.0340 3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -6.7620 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -6.9360 5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -6.3830 5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -5.6560 5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -5.4860 3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -4.3560 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.4240 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.2700 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -3.5360 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.3820 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -3.3190 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -4.4730 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -2.6060 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -1.4330 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -1.8190 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -0.1410 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -0.0830 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -1.7520 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -0.4350 -5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 0.6510 -4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 3.0240 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 4.6920 -3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 3.9850 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 1.6100 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -3.9770 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -7.8520 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -6.6960 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -6.6560 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -7.1930 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 -7.5030 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -6.5180 7.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -5.2240 5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -4.9210 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 39 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 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 M END