PUBCHEM-ZINC05732555 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 1.3540 0.2560 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.0860 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.0470 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.0770 0.2150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5620 -2.8280 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -1.7570 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -2.7070 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -2.1140 2.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 0.1030 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 0.7430 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.9450 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.5020 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -2.1830 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -3.0370 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -1.6680 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -1.5130 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -2.6160 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -0.9090 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 0.1810 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.8600 -0.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -3.7750 1.1020 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4960 -0.2840 -1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -1.0100 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 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 12 1 0 0 0 0 2 20 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 19 22 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 21 -1 M END