IFLAB-ZINC05268370 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3580 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0140 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6890 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0070 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.3970 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.0660 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 1.7980 -0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 0.7520 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -0.3550 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 0.7810 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -0.4010 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 -0.3700 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 0.8360 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9760 2.0140 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 1.9900 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0920 0.8630 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7800 -0.1800 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 -1.1000 -1.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2840 -0.2040 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8050 -1.4680 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1150 -1.4900 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5930 -2.6490 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7620 -3.7890 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4510 -3.7660 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9780 -2.6040 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2280 -4.9230 -2.8600 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.8740 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5590 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7570 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 3.1340 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 -1.3380 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 -1.2840 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 2.9490 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 2.9040 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5660 1.6330 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6930 0.6600 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5870 -0.1690 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9830 -0.6010 -3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8350 -2.6660 -4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5820 -4.6550 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7400 -2.5850 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 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 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 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 40 1 0 0 0 0 25 41 1 0 0 0 0 M END