PUBCHEM-ZINC04095529 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.2110 1.6980 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 0.1700 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3620 -0.1700 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -0.4790 0.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.0650 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -1.9990 0.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0600 -2.4570 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.3500 1.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6980 -2.0820 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.5660 1.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4700 -1.9240 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.1620 1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.8010 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -3.8140 1.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -4.8960 2.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -6.1860 1.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -4.4400 3.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -4.6440 1.4440 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6750 -2.4470 0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -3.4150 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -0.2060 -0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -0.8280 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 2.2650 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 1.7960 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 2.0340 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 2.0930 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -1.3820 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -3.9640 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 18 -1 M END