IBS-ZINC00545680 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 0.6250 -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 -0.4780 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1420 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -2.5400 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -3.8600 4.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 -4.5020 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -5.9020 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -6.5070 6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 -5.7560 7.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -4.3920 7.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -3.7400 6.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -2.3270 6.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -1.7860 5.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -1.5350 7.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -0.0760 7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 0.5560 7.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 2.0800 7.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 2.5560 8.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 1.9250 7.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 0.4010 7.7460 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 1.3540 -3.7090 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 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 2.8250 -6.4970 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -7.5850 6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -6.2600 8.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 -3.8210 8.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -1.9440 8.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 0.2200 6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 0.2600 8.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 0.2160 7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 2.5300 8.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 2.3760 6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 2.2600 9.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 3.6420 8.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 2.2640 8.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 2.2210 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.0490 7.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 0.1050 8.7930 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M END