NIH-ZINC01052741 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.9640 0.1040 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.9960 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 0.1690 -1.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -0.1540 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.1070 -3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -0.4180 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -1.1980 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.4860 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -0.9480 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -1.1380 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.9130 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -2.4590 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -2.2670 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -0.3870 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.2830 0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -1.8280 -2.8700 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -1.3710 -4.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -1.5580 -1.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -3.4760 -2.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 -4.0840 -4.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5150 -3.3800 -4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -5.3570 -4.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 -4.9980 -5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -4.7980 -6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2540 -4.4900 -6.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 -4.3020 -7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8600 -4.4830 -5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 -4.7960 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 -4.8570 -2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4820 -4.6090 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 -4.2970 -3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 -4.2380 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -4.4280 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -4.1890 -2.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -0.4240 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.6190 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 0.7200 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 1.7200 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.5240 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.7170 -4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -0.1970 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -2.0950 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -3.0600 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -2.7100 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7170 -4.0380 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -6.0240 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6890 -5.8570 -5.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 -4.8700 -7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 -5.0990 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7360 -4.6560 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4720 -4.1030 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9300 -3.9930 -5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -4.9990 -4.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -5.2010 -4.1540 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 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 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 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 53 54 1 0 0 0 0 M END