| cif2xyz() | cif2xyz() |
cif2xyz - Read CIF files and print atom coordinates in XYZ format.
cif2xyz --options input.cif
Read CIF files and print atom coordinates in XYZ format.
--print-radii
Append covalent radii to the atom coordinates.
--no-print-radii, --dont-print-radii, --xyz-only
Print only Cartesian XYZ coordinates for input atoms
(default).
--add-xyz-header
Add the total number of atoms on the first line of
the output, followed by an empty line.
--do-not-add-xyz-header,
--dont-add-xyz-header,
--no-add-xyz-header
Do not add the total number of atoms on the first line
(default).
--use-perl-parser
--use-c-parser
Specify parser to parse CIF files. C parser is default.
--help, --usage
Output a short usage message (this message) and exit.
--version
Output version information and exit.
Report cif2xyz bugs using e-mail: cod-bugs@ibt.lt