NIH-ZINC04019701 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.5890 0.2770 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.1710 -0.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1100 -2.0980 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -1.7240 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -2.5540 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -3.7700 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -4.1660 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -3.3240 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.7400 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -4.6880 0.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.9340 -0.8550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9380 -3.1720 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -2.2620 -1.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4820 -0.8090 -1.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7240 -0.5760 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -0.5850 -1.5270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7370 -0.8550 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -1.4510 -0.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5010 -1.2330 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 0.7920 -1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 0.1160 -2.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0450 1.1570 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -0.2000 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 0.6840 -4.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -1.6120 -4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -2.5800 -3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -3.8620 -3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -1.9920 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -1.8660 -6.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -2.4800 -6.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 0.3220 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 0.5330 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -2.4910 -1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -4.0660 -0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -5.3590 1.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.3580 -2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 0.4280 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 0.9520 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 0.4810 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -0.7770 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -2.2480 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -4.4110 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 1.0930 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -4.0350 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -2.5130 -5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -2.7990 -7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 1.3890 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -0.2280 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 0.1350 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 0.0650 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 1.5910 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 0.4280 -2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -3.4120 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -3.1960 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -5.3160 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -1.1880 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -0.1210 -2.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 36 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 34 2 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 57 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 57 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 57 1 0 0 0 0 33 53 1 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 M END