PUBCHEM-ZINC03871785 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 0.0290 1.4810 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.1560 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -0.8860 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.3740 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -0.5490 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -0.6360 0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -1.1650 1.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5470 -2.0140 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -0.0940 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 0.1760 -0.8380 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 0.0320 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -1.6490 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -1.2450 3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 0.4760 -1.6220 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 1.9130 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 2.2200 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 1.3490 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -1.0710 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -1.8510 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -0.5620 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -0.5020 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -0.3480 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 0.8660 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 0.8950 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -2.3780 2.7850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 14 24 1 0 0 0 0 M CHG 1 25 -1 M END