PUBCHEM-ZINC05178759 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9700 1.6240 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 3.5560 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 4.0980 0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.5960 -1.5570 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 2.1790 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 2.7520 -0.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 2.0300 -2.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.5210 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 3.0730 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 1.6040 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 2.3510 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.1480 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 4.2910 -0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 5.2500 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 M END