NIH-ZINC01136173 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -2.0430 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.5250 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.0290 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4970 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -3.6060 -0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -3.4480 -1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -3.4620 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.2210 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -5.8480 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -7.1160 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -7.7640 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -7.1380 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -5.8600 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -7.8260 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -7.2780 3.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -9.0620 2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -9.7080 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -10.8930 3.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -11.3570 4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -10.5240 5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -9.0610 5.1700 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 -1.0210 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.1550 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.1400 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.4090 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -2.4000 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -2.3870 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.3850 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.1170 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.1410 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -5.3440 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -7.6000 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -8.7540 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -5.3720 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -9.4990 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -12.3310 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -10.7150 6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 M END