NIH-ZINC06498871 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 4.9440 2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 5.7650 1.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6810 5.5240 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 7.2310 2.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1760 7.1490 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 5.7000 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 5.2630 3.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 8.0750 3.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 7.8880 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 7.2270 3.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 9.3280 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 9.9410 3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 11.2860 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 12.0420 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 11.4380 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 10.0950 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 13.3720 2.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 14.0890 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 15.5420 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 16.4290 2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 17.7620 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 18.2070 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 17.3200 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 15.9880 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 5.5290 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 5.4780 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 5.2600 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 5.1010 -2.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 5.1440 -1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 5.3640 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 7.7760 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 9.3550 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 11.7600 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 12.0290 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 9.6280 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 14.0010 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 13.6720 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 16.0810 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 18.4550 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 19.2480 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 17.6680 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 15.2950 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 5.6060 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 5.2180 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 5.0090 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 5.4020 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 61 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 61 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 M END