IBS-ZINC04062039 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.0400 1.6000 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.0750 0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7640 -0.2370 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -0.4400 1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3920 0.3340 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -0.7560 2.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7290 0.0950 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -1.0100 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -1.5570 1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.5390 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.0020 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.1970 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -1.4190 3.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -1.6840 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -2.4420 0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -1.9810 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 2.0410 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 1.9470 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.8970 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -0.5980 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.8740 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.8770 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -2.0730 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -2.9150 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.1700 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -3.2350 4.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -3.3180 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 26 27 1 0 0 0 0 M END