Mercurial > repos > bgruening > openbabel

diff filter/test-data/obgrep_on_8_mol.smi @ 0:527ecd2fc500 draft

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author bgruening
date Thu, 15 Aug 2013 03:25:06 -0400
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/filter/test-data/obgrep_on_8_mol.smi	Thu Aug 15 03:25:06 2013 -0400
@@ -0,0 +1,4 @@
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+CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([C@H]3C[C@@H]2[C@@H]1C(=O)OC)[nH]c1c4ccc(c1)OC)OC(=O)c1cc(c(c(c1)OC)OC)OC.C1Nc2cc(c(cc2S(=O)(=O)N1)S(=O)(=O)N)Cl	
+