PUBCHEM-ZINC05224270 MOE2007 3D CORINA 3.40 0006 02.08.2006 17 17 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -0.6640 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 0.0200 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.3390 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.0580 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 3.5380 0.0090 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1780 4.1660 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 4.1280 0.0020 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2600 -2.0540 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -2.7240 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5300 -2.0900 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -3.9420 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9190 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.8640 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -2.5590 -0.0150 H 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 14 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 11 1 M CHG 1 13 -1 M END