IBS-ZINC05489243 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.4990 2.0100 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.5170 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 0.0690 0.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1490 0.6920 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -1.3700 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.2010 1.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 0.1990 0.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 0.9870 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 1.6250 2.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 1.0450 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 1.7740 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 2.4240 3.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 3.3070 4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 3.7080 5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 3.0600 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 2.2970 4.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 3.1870 6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 2.4720 5.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.5940 6.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 3.4240 7.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 4.1360 7.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 4.0170 7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 3.5390 8.2040 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -0.0430 0.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -0.4820 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -1.5560 -1.1130 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.1910 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 2.3300 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 2.5740 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 0.3370 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.0470 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 1.8530 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 3.6250 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 4.3960 6.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 1.8250 4.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 2.0420 6.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 4.7810 8.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 4.5690 7.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -1.7290 0.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.6630 1.1000 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