NIH-ZINC04961190 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7090 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1100 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.1360 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7200 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.0540 -2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.7710 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.1690 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.8520 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -2.8610 -4.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8140 2.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.2630 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -5.0000 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -4.6250 4.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -3.1750 4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -2.4380 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -5.3340 5.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -5.2150 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -5.9170 7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -6.7380 7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -6.8600 7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.1560 5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -6.2700 4.9990 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1880 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.0250 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.2540 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.9320 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -3.0490 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -4.5580 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.5170 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -6.0750 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -4.7260 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -2.9210 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8800 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -1.3630 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.7130 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.5750 6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -5.8250 8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -7.2850 8.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -7.5020 7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7740 0.0000 N 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 12 1 0 0 0 0 4 45 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 M END