MAYBRIDGE-ZINC00164985 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0480 1.3950 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.0030 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 0.0460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4470 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 2.1150 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.7040 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -0.1370 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 0.8500 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -1.1350 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -2.3060 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 -2.0220 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -3.6540 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0100 -3.7390 -0.0840 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0020 1.9160 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5690 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.7530 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 2.0500 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.2010 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 -0.9450 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -4.6510 -0.0590 O 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 M CHG 1 14 -1 M END