NIH-ZINC03958439 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0910 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7480 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9650 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0130 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.4610 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5090 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4010 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3380 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.3880 4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -1.5890 6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -1.6370 7.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -0.3760 6.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -0.1510 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1030 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -0.3540 7.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 0.7550 6.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 0.7750 7.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 -0.3100 8.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 -1.4160 8.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -1.4380 7.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8650 -0.2880 8.5450 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.8960 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -4.3580 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -5.7840 3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -6.8250 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -8.1330 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -8.4000 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -7.3600 5.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -6.0510 4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -0.5020 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.2810 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.5350 6.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.7760 7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -1.7750 8.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -2.4670 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 0.7950 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -0.9640 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 0.7270 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.0350 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 1.6010 6.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 1.6370 7.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1930 -2.2610 8.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -2.3000 8.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -3.9590 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -4.5340 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -4.2950 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -3.7200 3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -6.6160 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -8.9460 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -9.4220 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -7.5680 6.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -5.2380 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -1.3640 5.2280 N 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 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 61 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 61 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 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 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 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