IBS-ZINC01782182 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.8710 2.4360 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.0500 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 0.5420 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 0.7010 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 0.2650 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -0.3320 3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.4900 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.0570 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.1930 2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -0.7610 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -1.2590 4.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -0.6950 3.3310 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7730 0.3000 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -1.7800 2.3360 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3510 -1.7210 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -1.4640 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -2.2570 2.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -3.0920 2.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -4.1310 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -4.0500 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 -5.4150 2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 -6.5940 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -7.8380 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -7.9120 4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -6.7420 4.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -5.4950 4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -0.8830 4.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 0.1850 5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 1.2470 5.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -0.0980 6.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 0.7800 7.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 0.5630 8.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -0.5290 8.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -1.4050 7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -1.1910 6.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 3.1640 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 2.7750 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 2.4430 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 0.3400 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 1.0880 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 1.1700 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 0.3920 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.6750 3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.9560 4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 0.1740 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -6.5490 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -8.7480 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -8.8810 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -6.8010 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -4.5960 4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 1.6370 7.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 1.2480 9.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 -0.6950 9.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 -2.2510 7.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 -1.8780 5.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -0.4120 1.2940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 18 19 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 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 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 34 35 1 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 M CHG 1 56 -1 M END