PUBCHEM-ZINC05420281 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -0.0740 1.7810 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 0.6250 -0.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2200 0.9260 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.5770 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.5770 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 0.3070 -0.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -0.5400 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.9010 -2.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 -0.9990 -1.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9840 -0.1170 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -2.0330 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -2.2180 0.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -2.0860 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -1.5480 -2.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -1.8290 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 -1.6810 -2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -1.3940 -2.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -2.2620 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 2.1100 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 2.6330 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.5000 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -3.0160 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -1.7580 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -3.3520 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -1.9720 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -1.8940 -4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -0.4110 0.4740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M CHG 1 27 -1 M END