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CIF examples

Examples of CIFs for authors of

  • reporting a single structure (SHELX)
  • reporting multiple structures (SHELX)
  • including a completed Validation Response Form (VRF)
  • including handling of disorder with the PLATON routine SQUEEZE
  • produced with SHELXL2013 or a later version
  • produced with JANA
  • produced with CRYSTALS
  • produced with OLEX2
  • for a powder diffraction study

Examples of CIFs with extra formatting

  • including an author-generated extra table
  • including definable text sections from publCIF

Structure factors should also be supplied in CIF format:

  • a structure-factor file generated by SHELX
publCIF
[publCIF]

publCIF - free software to edit and preview a CIF for publication

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