IBS-ZINC05489246 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.8020 0.8890 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.6050 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -1.0980 1.6270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9580 -0.8540 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -2.5910 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -3.0630 2.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.4470 2.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 0.3010 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 0.4760 3.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.8890 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 1.6960 5.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 2.2040 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 2.9050 6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 3.2140 6.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 2.6930 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 2.0840 4.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 2.7830 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 2.2100 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 2.2970 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1950 2.9510 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 3.5210 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 3.4460 5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 3.0330 2.6020 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 0.3380 4.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -0.5960 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -1.5060 1.5180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 1.0530 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 1.2400 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 1.4370 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.7700 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -1.1540 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 1.9460 6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 3.1640 7.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 3.7580 7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 1.7000 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 1.8540 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8850 4.0290 4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 3.8950 6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -3.3970 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -4.3480 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 39 40 1 0 0 0 0 M END