IFLAB-ZINC05259458 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 0.0320 1.3300 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.1430 0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.4750 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 0.0530 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -0.5710 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -1.7370 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -2.2680 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -1.6410 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.1590 2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -3.3560 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -2.4050 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 -3.4200 1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -1.8910 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -2.5820 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -1.8780 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7040 -2.5570 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7140 -3.9510 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5140 -4.6550 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -3.9720 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0000 -4.6840 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0120 -6.0830 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2360 -6.7210 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3840 -5.9300 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2780 -4.6100 -0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1430 -4.0150 -0.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.6360 -6.5270 -0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.6980 -5.5150 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0440 -6.2030 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3240 -7.1810 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1800 -8.1940 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8590 -7.4490 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.7220 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 1.0980 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 2.0760 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.9540 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -0.1580 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -3.1690 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -3.6610 3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -3.1740 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -4.1460 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -1.0420 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -0.7980 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6320 -2.0090 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5200 -5.7350 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -4.5170 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0940 -6.6480 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3020 -7.7990 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7360 -4.9600 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4890 -4.8290 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8340 -5.4530 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0110 -6.7470 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3950 -6.6320 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2610 -7.7040 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3520 -8.8670 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1330 -8.7700 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0400 -8.1680 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9010 -6.8850 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END