Difference between revisions of "DMol3 coordinates"

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Line 3: Line 3:
 
  |mime=Undefined
 
  |mime=Undefined
 
  |url=Unknown
 
  |url=Unknown
  |notes=One record per input file, One record per output file
+
  |import=Yes, One record per input file
 +
|export=Yes, One record per output file
 +
|version=All
 +
|dimensionality=3D
 
  |options=
 
  |options=
 
<pre>
 
<pre>
Line 9: Line 12:
 
         s  Output single bonds only
 
         s  Output single bonds only
 
         b  Disable bonding entirely
 
         b  Disable bonding entirely
 
 
</pre>
 
</pre>
 
}}
 
}}
  
 
[[Category:Formats]]
 
[[Category:Formats]]

Latest revision as of 09:42, 30 January 2006

Filename Extensions dmol
Chemical MIME Type Undefined
Specification URL Unknown
Import Yes, One record per input file
Export Yes, One record per output file
Open Babel Version All

Options

        Read Options e.g. -as
        s  Output single bonds only
        b  Disable bonding entirely

Additional Comments