PUBCHEM-ZINC05133225 MOE2007 3D CORINA 3.40 0006 02.08.2006 15 15 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3150 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -0.4160 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -1.6140 -0.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9510 -2.6910 -0.0320 N 0 5 0 0 0 0 0 0 0 0 0 0 2.1100 0.6250 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.7380 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 3.1230 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.0660 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.9540 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 3.6750 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 3.6650 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 4.2740 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 4.2060 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 6 1 0 0 0 0 4 5 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 M CHG 1 4 1 M CHG 1 5 -1 M END