PUBCHEM-ZINC04530263 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.1040 1.3540 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.1430 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4910 -0.4500 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 0.4720 1.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5000 0.5550 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 2.0570 0.5880 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -0.0130 0.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0790 0.0020 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 0.8100 0.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8160 0.9380 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 0.0830 -0.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7250 -0.0990 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 0.8710 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2530 0.0690 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -0.8320 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -1.2000 0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -1.5880 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 2.1040 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 2.4980 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -1.4000 0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -1.7470 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.7750 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.9770 1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 1.7700 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 1.6320 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 1.8110 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 1.0860 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.5600 1.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.5650 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -0.9820 -0.6180 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 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 28 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 30 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 30 -1 M END