IBS-ZINC05032369 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -2.6410 -0.7570 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -1.4430 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -0.6030 0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 0.3270 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -0.3600 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.7230 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -1.4580 1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 0.0980 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.2480 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 2.0250 4.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.6590 5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.4720 5.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -0.2990 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 0.1560 6.5990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7090 0.7610 6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -1.2570 6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -1.4780 8.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -0.2680 8.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 0.4790 7.7000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8160 -0.0030 7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 1.9720 7.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5760 2.0950 8.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 2.4190 6.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 2.9910 8.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 2.5300 8.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -1.4070 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 0.1790 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -0.5190 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -1.6920 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -2.3860 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 1.1460 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 0.7790 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -1.1350 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -0.8360 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 0.3690 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.5410 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 2.9180 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -1.2040 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -1.9740 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.3960 8.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 0.2600 9.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.5420 9.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 3.3540 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 4.1830 8.4280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 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 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 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 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 44 -1 M END