NIH-ZINC04101431 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.0000 1.4860 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0420 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.6170 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.5460 0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -1.7400 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.3980 -0.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -2.2460 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.5120 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 -3.1160 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -3.9580 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -3.5380 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -4.3480 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -5.5410 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -5.9570 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 -5.1860 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -3.5040 -0.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -3.6520 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8710 -4.1590 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 -3.2140 0.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2800 -3.0660 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 -2.5580 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0610 -3.6050 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0320 -2.8360 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3540 -3.2370 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6620 -4.3990 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6480 -5.1130 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.8610 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8950 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.7880 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.3440 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.3140 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.7050 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -0.2420 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.0210 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -0.5540 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -4.0340 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -6.1700 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -6.9040 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0880 -5.5220 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 -4.3660 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 -2.6860 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 -5.1370 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2160 -4.2420 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 -4.0310 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9230 -2.3520 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -1.5810 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 -2.4760 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7580 -1.9380 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1300 -2.6600 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6850 -4.7390 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8830 -6.0170 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -1.9600 0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3940 -4.7100 1.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 35 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 52 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 53 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 53 1 0 0 0 0 M END