NIH-ZINC04302305 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.0970 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3470 -2.3120 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.6450 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -3.3980 -2.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -2.4820 -2.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -1.9480 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -3.6500 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -4.3200 -1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -4.0740 -3.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -5.3430 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -5.5840 -4.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -5.1190 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 -5.3400 -5.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 -6.0280 -6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -6.4940 -6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -6.2760 -5.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.9880 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.4480 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.5450 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -3.5400 -4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -5.2990 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -6.1560 -3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -4.5820 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 -4.9760 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -6.2000 -7.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -7.0300 -7.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -6.6430 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -2.3640 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -2.7890 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 10 11 1 0 0 0 0 10 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 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 38 39 1 0 0 0 0 M END