PUBCHEM-ZINC06363602 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 -0.3420 1.3240 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.0900 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.6820 0.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.7090 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7680 -0.1350 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -0.6710 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -1.6220 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -1.1080 -4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -2.0630 -1.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.3760 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -1.5350 -0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -3.8560 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -4.1990 -1.9620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 1.9840 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 1.3650 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 1.6570 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 0.3570 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -0.9740 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.7800 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -4.4510 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -4.1500 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -5.5260 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.8190 -3.1010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 M CHG 1 23 -1 M END