PUBCHEM-ZINC06035954 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.0470 1.5680 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.0730 0.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4990 -0.4700 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.4700 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 0.3410 0.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.3570 1.6630 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.0190 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -0.4720 2.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5780 -1.5630 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.1980 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 0.9530 3.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.9090 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8120 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 2.1560 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -0.4670 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 1.1020 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.6720 -0.1440 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4940 -0.0680 1.0630 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0050 -0.0190 3.7020 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0380 -0.7590 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 0.4240 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 0.6920 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 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 17 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 18 -1 M CHG 1 19 1 M END