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view chemfp_mol2fps/test-data/CID_2244.inchi @ 19:a03d5daa3bf9

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ChemicalToolBoX update.
author Bjoern Gruening <bjoern.gruening@gmail.com>
date Wed, 29 May 2013 17:42:28 +0200
parents 0e5307e9a072
children
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InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)