PUBCHEM-ZINC01456652 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5130 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -2.0390 1.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1420 -2.4780 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -2.4020 -0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -1.6260 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -2.1240 -2.6480 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4770 -1.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -2.5530 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.8350 2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -0.0760 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.2370 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -3.2190 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 0.0510 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -2.6970 3.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -3.0300 4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 20 21 1 0 0 0 0 M END