IBS-ZINC04888546 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.1070 1.6260 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.1220 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -0.4190 -0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -0.6600 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.0100 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -2.4200 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -3.5660 0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -1.3370 0.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -0.1520 0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8700 0.3750 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 0.7640 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 2.1290 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 2.9690 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 2.4460 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 1.0830 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 0.2390 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -1.0950 2.8080 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -1.3390 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -2.5420 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 -2.5480 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -1.3430 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9140 -0.1360 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -0.1370 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0710 -1.3460 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 -2.3960 0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.8470 0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 2.0520 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.9570 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.9560 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 2.5380 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 4.0350 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 3.1040 4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 0.6740 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -3.4730 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -3.4820 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 0.7960 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 0.7950 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -3.7810 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7530 -0.1840 0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7140 -0.2360 0.8530 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 2 0 0 0 0 2 4 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 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 26 38 1 0 0 0 0 39 40 1 0 0 0 0 M END