IBS-ZINC02051503 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0050 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.6310 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.8700 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4770 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1420 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -2.5400 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -3.5620 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -4.1680 6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -3.7890 6.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -2.8250 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -2.1640 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -1.1250 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -0.3000 3.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -2.3700 6.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -3.5220 7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 -3.3070 8.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 -3.9110 10.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2050 -4.8100 11.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 -6.2750 10.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -6.5810 10.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -5.6300 8.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -5.2550 6.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -5.8720 7.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -6.8830 8.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -7.2840 8.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -6.6760 7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -5.6600 6.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.5930 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -3.7100 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1140 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.2210 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -3.8800 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -3.3460 8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 -4.5460 7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 -3.4830 7.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 -2.2830 8.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 -2.8670 10.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9980 -4.0670 9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1100 -4.5750 11.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 -4.6440 12.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 -6.4510 10.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 -6.9210 11.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -7.6110 9.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 -6.4430 10.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8310 -5.7790 8.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 -5.8360 8.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -5.5590 8.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -7.3620 9.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -8.0760 8.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -6.9940 6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -5.1820 5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -4.2420 9.3870 N 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 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 3 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 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 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 M END