SHELIN : Enter SHELX file

SHELIN [a] Option Code Arg   Def
  shelx control instructions new   external file  
    old   in line within compid.dat  
  population treatment pop   force atom pop to 1.0  
  shelx source file(s) basename [b] file path (256 chars max) instructions from compid .ins
        reflections from compid .hkl

[a] See also the program OUTSRC for exporting an Xtal archive back to Shelx input format.

[b] Should be used as the last option on the SHELIN line as embedded blanks are permissible, as well as the DOS disk identifier ":" and directory separators.

The following SHELX lines are translated into XTAL commands [a]
TITL, CELL, LATT, SYMM, SFAC, UNIT for STARTX
HKLF for DIFDAT/ADDREF
FVAR for ADDATM

[a] The recognised data are: the standard SHELX hkl lines (two formats) following HKLF, and the standard atom lines following FVAR. The CELLto UNITcommands must always be input, and the FVARcommand and atom lines, if entered, must be the last in the SHELIN sequence. All other SHELX lines will be ignored.


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