PUBCHEM-ZINC05157182 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 19 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4350 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.0850 0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5460 -0.4050 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -0.6400 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 0.1220 -1.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7670 -0.2310 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 1.8570 -0.9600 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 0.0760 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.4180 0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -0.0420 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -1.9460 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.4930 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -0.5040 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -0.6910 -2.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 1.9330 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 1.8080 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -0.9320 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 0.7550 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -0.5810 -0.6230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 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 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 M CHG 1 19 -1 M END