PUBCHEM-ZINC06565841 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 1.8360 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7520 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 0.7090 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.3540 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 0.6890 -0.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 -1.0500 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -1.5540 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 -2.9240 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -3.7140 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 -3.2090 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -1.9010 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -4.0680 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9870 -0.6410 -0.0870 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1170 -1.0950 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 0.5650 -0.0800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 -3.3460 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -5.0280 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -3.7110 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END