PUBCHEM-ZINC03588524 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.1660 1.5900 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 0.1000 -0.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0130 -0.2160 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 0.0750 0.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5680 -0.2320 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 1.8520 0.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 -0.3020 0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3710 -1.3670 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 0.5010 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -0.0010 0.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -0.1120 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -0.1700 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -0.3710 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -0.3820 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.5270 1.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.8990 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 2.2090 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 1.5590 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 0.4090 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -0.6260 -0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.5390 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 0.3990 1.3980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 22 -1 M END