PubChem

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Filename Extensions pc
Chemical MIME Type Undefined
Specification URL ftp://ftp.ncbi.nlm.nih.gov/pubchem/data_spec/pubchem.xsd
Import Yes
Export No
Open Babel Version 2.0.0 and later

Options

 Minimal extraction of chemical structure information only.

Additional Comments

Only the essential data for chemical structure are used in this read-only format, and the potential large amount of other information is currently ignored. The format seems to handle multiple conformers, but only one is read (This needs testing).

More information on PubChem can be found at http://pubchem.ncbi.nlm.nih.gov/

Retrieved from "http://openbabel.org/wiki/PubChem"
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