NIH-ZINC06577550 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 0 0 0 0 0 0999 V2000 -0.5330 1.1950 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -0.3080 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -1.0330 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -2.3500 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -2.4540 -0.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -1.1580 -1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.7010 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -3.4950 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.3530 2.5900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.3510 3.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 0.9550 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -0.1650 3.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -1.2920 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -1.2110 5.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.3020 5.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -2.1490 6.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -2.0710 7.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -3.2290 8.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -4.4170 8.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -5.4820 9.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -5.3630 9.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -4.1660 9.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -3.1010 8.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -4.3000 10.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 -5.4460 11.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -6.2450 10.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 1.0700 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 1.1630 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 2.3820 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 3.5130 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 3.4210 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 2.2010 3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 4.7130 3.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 5.8360 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 1.5570 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.4840 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 1.6280 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -4.0110 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -3.5430 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -4.4770 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -3.7720 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -4.3490 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -3.1920 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -1.2520 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -2.2280 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -2.8760 5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.1100 7.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -1.1340 8.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -4.5120 8.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -6.4090 9.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -2.1700 8.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 -5.1430 12.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 -5.9920 11.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 0.2830 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 2.4550 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 4.3020 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 2.1280 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 5.9840 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 6.7280 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 5.6530 4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 M END