IBS-ZINC05347918 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 0.3480 -2.2540 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.1740 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.4970 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -0.2880 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.3000 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 1.2190 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 1.6210 0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 1.9230 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 2.2770 -0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 2.3650 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0570 2.1200 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 1.6920 1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 2.2560 2.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9640 1.3150 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 2.3560 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 2.1970 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 2.3250 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 2.6150 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4510 2.7530 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7330 3.0390 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 3.1890 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3710 3.0550 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0570 2.7690 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 2.6250 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 2.7540 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 3.3850 3.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 3.4990 5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 4.8290 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 5.4390 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 4.5720 3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.9190 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -3.2890 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -1.6440 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -2.5400 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.7630 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 0.3990 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -1.3570 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.0850 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 0.5660 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.1670 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.8090 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -0.6730 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 1.4920 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 1.7750 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 1.8380 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3430 1.9780 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6490 2.2010 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2800 2.6370 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7640 3.1430 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9090 3.4110 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 3.1780 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 2.7240 5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 5.2880 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 6.4330 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.7300 1.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2570 -0.1450 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 1.3780 3.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 1.4910 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 55 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 57 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 55 1 M END