PUBCHEM-ZINC05134862 MOE2007 3D CORINA 3.40 0006 02.08.2006 20 21 0 0 1 0 0 0 0 0999 V2000 -0.0320 1.6100 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.0820 -0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6600 -0.3330 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -0.3990 -0.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 0.6490 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 0.6040 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 1.8170 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 1.8220 0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 3.0970 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 4.1560 0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 3.0530 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 1.9170 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -0.3870 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.1930 2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 1.9340 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 2.0950 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -0.2680 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 0.4810 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 3.9810 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.2790 1.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 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 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 M CHG 1 20 -1 M END