NCID-ZINC05823979 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 70 0 0 1 0 0 0 0 0999 V2000 -0.2650 1.5510 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 0.0400 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0920 -0.4480 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.4860 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.9570 2.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -0.4320 1.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.0020 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -1.0310 2.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7340 -1.9040 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -1.4530 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -2.5600 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -2.9170 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -3.1530 0.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -0.0220 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 1.0870 3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.3530 4.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -1.2400 4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 0.6270 5.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2260 1.6240 5.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 0.2890 6.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 0.4470 5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 0.1140 6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -0.2160 7.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 0.5910 6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -0.1780 6.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.4130 7.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.2320 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -0.4940 -1.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9900 0.0060 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -2.0040 -1.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5310 -2.3900 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -2.6900 -0.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9020 -2.5260 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -2.1400 -0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -0.7410 -0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2840 -0.5520 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 0.0250 -1.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9640 1.0890 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -0.1790 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -0.2710 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -0.8990 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -4.0920 -0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -2.2690 -2.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -2.2470 -3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -2.0080 -3.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.5190 -5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 1.7640 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 1.9170 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 2.0470 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 -0.6000 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 -1.8070 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -2.8670 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -3.8660 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 0.9640 7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -0.7400 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 -0.2280 4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 1.4760 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 2.0280 7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 1.3900 8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 0.1270 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 0.8110 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -0.5400 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8160 -0.6470 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -4.5910 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -2.4600 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.5810 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -2.9760 -5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -3.1950 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 0.1840 6.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7400 -0.0390 6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 69 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 37 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 40 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 39 60 1 0 0 0 0 40 41 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 42 64 1 0 0 0 0 43 44 1 0 0 0 0 43 65 1 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 46 66 1 0 0 0 0 46 67 1 0 0 0 0 46 68 1 0 0 0 0 69 70 1 0 0 0 0 M END