NIH-ZINC00614831 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6460 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -1.9920 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.7460 1.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.3580 3.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -3.6660 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -3.6260 4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -4.6680 5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -4.8170 5.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -4.7310 4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -0.8610 1.0970 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -1.7800 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.1470 -0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 0.6060 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 0.8780 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0290 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 2.9070 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 2.6340 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 1.4810 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 4.1630 2.4210 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.5750 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 0.1400 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -1.7540 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -3.9440 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -2.6340 4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -3.8860 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -4.3040 6.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -5.6190 5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.0020 6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -5.7830 6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -5.6910 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.4120 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 0.1920 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 2.2430 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 3.3210 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 1.2660 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 3.9590 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 4.9430 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 4.4930 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 M END