PUBCHEM-ZINC05113937 MOE2007 3D CORINA 3.40 0006 02.08.2006 20 19 0 0 1 0 0 0 0 0999 V2000 0.0060 1.5270 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.0110 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.5830 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0050 -0.0930 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.1100 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -2.7820 -0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -0.3900 -1.5420 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 2.0990 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0070 1.6010 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 3.6230 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 4.3030 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.9210 -1.5780 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.9200 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8790 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.3960 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -0.3710 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -1.3410 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 2.8780 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -2.5160 1.2420 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0990 4.0190 1.2330 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 7 1 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 12 18 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 20 -1 M END