PUBCHEM-ZINC06066790 MOE2007 3D CORINA 3.40 0006 02.08.2006 18 18 0 0 1 0 0 0 0 0999 V2000 0.1480 1.3730 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.0500 0.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0370 -0.7900 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.0840 1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -0.7430 2.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3100 -1.8220 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.0850 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 0.0070 0.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.5110 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 0.6670 4.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -0.6950 1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -0.0130 0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 1.4250 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.4920 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 2.2350 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -0.6870 2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 0.9290 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.5580 4.3590 O 0 5 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 11 12 2 0 0 0 0 M CHG 1 18 -1 M END