NCID-ZINC06005551 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 85 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.3660 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0170 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6920 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0220 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4160 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0800 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -0.6970 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 0.0480 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -0.6130 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -2.0760 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 -2.8310 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 -4.1920 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -4.8410 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 -4.1370 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -2.7300 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -2.0130 -0.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 0.1300 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4410 -0.4710 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3870 1.4750 -0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 2.2110 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3730 3.7110 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 4.4800 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 6.6910 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3540 8.1820 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6560 8.9860 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3490 10.4140 -0.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3470 11.3190 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5030 10.9510 -0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0370 12.7610 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 13.2220 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4800 14.5980 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4500 15.4800 -1.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7350 15.1260 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0980 13.7590 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4470 13.3930 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4040 14.3560 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0540 15.7000 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7510 16.0900 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0770 15.0770 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 16.4390 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 16.8790 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 15.9710 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 14.6190 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 14.1670 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8900 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5700 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7720 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9740 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1600 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 1.1280 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 -2.3390 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0940 -4.7750 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -5.9200 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -4.6550 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5480 1.9550 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1840 2.0120 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 1.8900 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8420 3.9100 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 4.0320 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 4.2800 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3080 4.1580 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2940 6.3850 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2130 6.5070 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8170 8.3660 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7360 8.4880 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1930 8.8020 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2750 8.6800 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4260 10.7080 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9080 12.5270 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7300 12.3530 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4460 14.0720 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8300 16.4440 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4970 17.1370 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6080 17.1490 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2770 17.9340 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 16.3200 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 13.9140 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2380 13.1100 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4260 5.9190 -0.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 6.1220 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 45 1 0 0 0 0 2 3 2 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 47 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 48 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 13 14 2 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 22 79 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 23 79 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 68 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 69 1 0 0 0 0 31 32 2 0 0 0 0 31 39 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 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