NIH-ZINC00251564 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.7400 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.2430 -0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5200 0.0790 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.4990 -1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0870 -0.2580 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.9840 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -2.8300 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -4.1520 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.3800 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -2.8680 0.0950 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 0.1120 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.4800 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 1.6440 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 1.4850 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.1270 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -0.2610 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.1610 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 0.3470 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -0.6660 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -0.6220 2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -1.1670 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -1.6400 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -1.4160 0.1850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 2.1680 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.8870 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 2.2320 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -2.5070 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -4.9390 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -5.3460 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.8080 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.9170 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 0.6850 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -0.3480 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 2.4160 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 0.6860 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 1.9490 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 0.9490 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.6660 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -0.2020 3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -1.2090 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6020 -2.0990 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -0.0880 -1.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 42 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 M END