PUBCHEM-ZINC04096493 MOE2007 3D CORINA 3.40 0006 02.08.2006 20 20 0 0 1 0 0 0 0 0999 V2000 -0.0290 1.4860 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.4750 -1.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0030 -0.1940 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 0.1820 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -0.4790 -1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 1.6780 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 2.0800 -0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9720 1.7060 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 3.6170 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 4.2070 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -1.8910 -1.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 1.8900 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.7700 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.4560 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -0.4450 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 1.9760 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 2.1550 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.0760 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 4.1050 0.2300 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 12 19 1 0 0 0 0 M CHG 1 20 -1 M END