NIH-ZINC04196636 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 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 3 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -0.5430 1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -1.0550 0.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -1.3950 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -1.0630 -1.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.2470 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -2.6010 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -3.4390 -3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 -2.1340 -1.4890 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -2.2440 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -2.8640 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -3.1990 -1.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2250 -3.0470 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4400 -3.6500 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2420 -4.3070 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5110 -4.9370 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3600 -3.8530 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5580 -3.1950 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2890 -2.5660 -1.2030 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 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.2960 0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -1.0850 2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -1.2400 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -1.7140 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -1.9390 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -1.5540 3.8790 S 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 -2.4130 -1.1790 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.4720 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -2.8810 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -4.4100 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -3.1600 -4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -2.8600 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -1.2450 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 -2.7790 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1670 -4.4030 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6370 -5.0800 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5150 -3.5540 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2380 -5.6900 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0820 -5.4050 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2640 -4.3010 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6330 -3.1000 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2850 -3.9480 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1630 -2.4230 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5620 -1.8130 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -2.0970 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -1.0140 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -1.8910 3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.3100 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 M END