NIH-ZINC04383509 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 -0.2530 0.1020 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.1950 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -1.6040 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.7140 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 0.5910 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 0.9950 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 1.4840 -0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 0.9410 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -0.1140 -0.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8380 0.3470 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.1330 -0.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -0.7180 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -1.7400 0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -0.1220 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 1.1930 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 1.0180 -2.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1940 0.3590 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 2.3890 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 2.2620 -4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 0.8280 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 0.4900 -3.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 -0.7900 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4140 -0.8510 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -2.1790 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7360 -3.2540 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -4.5280 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4170 -4.7280 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 -3.6480 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0270 -2.3760 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -5.9810 -2.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5210 -0.0020 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 1.0000 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7790 -0.4110 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9180 0.3540 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1470 -0.5600 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2380 0.0230 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4500 0.8350 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3050 1.4620 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 0.4200 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -1.8900 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.6180 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 2.0080 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 1.7350 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 0.4780 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 1.7140 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 1.7760 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1260 3.1860 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6310 2.5710 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 2.9950 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 2.3810 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 0.8080 -5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 0.1400 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0020 -3.0970 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 -5.3670 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -3.8010 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7400 -1.5360 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -6.4560 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 -1.2120 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6660 0.7940 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8960 -1.5740 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4930 -0.5640 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8030 -0.7780 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9040 0.6770 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0500 0.1780 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0770 1.6110 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6580 2.3470 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 1.7100 0.8680 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 31 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 38 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 M END