PUBCHEM-ZINC03825298 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0920 1.6280 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 0.1770 0.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6770 0.1220 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 0.6520 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.9860 0.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8420 2.3360 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.3730 -1.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.8100 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -1.9030 1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 2.2920 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 1.7190 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 0.5780 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 0.3080 1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.2500 -0.1070 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2980 -1.2630 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 0.0190 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 3.4970 -1.1400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7950 3.0920 1.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 3.7720 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 3.6150 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -0.4220 1.5180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 14 1 M CHG 1 17 -1 M CHG 1 21 -1 M END