PUBCHEM-ZINC02574391 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 0.3330 1.4400 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.0760 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -0.6980 -0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.0770 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.7720 -0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -0.4440 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7450 -1.4900 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -0.2820 1.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7170 0.1190 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 0.8300 1.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0470 1.8130 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 0.6750 -0.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5070 -0.1280 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 0.2940 -1.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 1.9620 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 1.7460 -2.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 1.2360 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6420 0.6480 1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -0.3070 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -1.3840 1.7060 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.5370 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 0.1000 -0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.9060 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 2.2350 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 2.7590 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2150 2.3040 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -2.3880 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -2.4270 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 M CHG 1 20 -1 M END