IBS-ZINC01752847 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.2910 1.0410 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -0.4180 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.2100 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -2.5510 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.4950 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -1.1930 -1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -3.5440 -1.6430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0670 -4.5440 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -3.4600 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -3.6310 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -3.8970 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -5.1090 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -4.8250 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -3.5260 1.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -3.0700 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -2.9480 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -1.5330 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -5.6680 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -6.8330 2.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -4.9520 3.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -5.6840 5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -6.4160 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -3.5140 -2.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -3.1390 -3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -2.9140 -4.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -3.1260 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.9000 -5.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -3.4150 -2.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -3.5600 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -2.2190 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -3.2200 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1230 -0.9410 -2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 1.3370 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 1.3490 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.5810 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.8630 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -3.4480 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -1.0070 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -0.9920 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -1.4910 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -6.5460 5.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -5.0210 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -6.0000 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -7.2260 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -6.6320 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -6.4190 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -3.6350 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -3.9790 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -4.2860 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 -1.8640 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -1.4590 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -2.8610 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -4.2350 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2310 -3.1980 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -0.3490 -3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 -0.4870 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 -1.0510 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -2.3130 -2.3930 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6980 -2.6980 -3.3280 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 6 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 23 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 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 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 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 58 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 58 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END