IBS-ZINC02195716 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.4460 1.5100 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.0180 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.4700 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -1.8110 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.3170 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -3.6780 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -4.5460 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -4.0340 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.6720 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -6.0090 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -6.8590 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -8.2310 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -8.7160 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -10.0810 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -10.4890 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -9.5640 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -8.2280 -4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -7.7690 -3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -6.4660 -2.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -9.1660 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -10.3640 -0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -8.6880 1.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -9.5970 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -10.0910 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 -11.0170 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -11.4600 3.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -10.9820 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -10.0480 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -9.5370 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -8.7240 2.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -10.0240 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 1.9340 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 1.8280 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.8550 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.3360 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.4420 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -1.6450 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -4.0710 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.7040 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -2.2750 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -6.4500 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -10.8070 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -11.5430 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -9.9110 -5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -7.5240 -4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -9.7510 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -11.3980 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -12.1830 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -11.3290 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -10.7450 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -10.5000 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -9.1790 4.7120 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END