NIH-ZINC04196646 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8190 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.3320 2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -3.7860 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 -4.1350 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -3.2490 3.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.7950 3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.4460 3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -3.7620 4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -4.9640 4.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -2.8410 5.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -3.6720 6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 -2.7510 7.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 -2.3460 9.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -1.5020 10.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2340 -1.0630 9.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 -1.4690 8.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4480 -2.3170 7.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 0.0140 11.0810 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 0.7070 10.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 0.6740 11.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6290 -0.9370 12.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 -1.7820 11.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -2.2580 13.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6390 -3.1260 12.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8870 -2.5580 12.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9700 -3.3540 12.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8060 -4.7190 12.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5580 -5.2880 12.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4760 -4.4920 12.7000 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -4.0980 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -4.2930 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -5.1730 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -3.9900 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -1.2880 4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -1.4830 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -0.4080 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -1.5880 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6290 -2.2000 5.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -2.2250 6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -4.3130 7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -4.2880 6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -2.6890 9.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 -1.1840 10.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0110 -1.1260 8.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -2.6370 7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -0.9360 13.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 -2.6450 11.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4880 -1.2070 11.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 -1.3950 13.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -2.8320 13.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0150 -1.4910 12.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9450 -2.9100 12.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6520 -5.3420 11.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4300 -6.3540 12.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5020 -4.9360 12.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 M END