From Just Solve the File Format Problem
Electronic Formats concerned with Chemical Data.
- CHM (ChemDraw file format)
- CIF (Crystallographic Information File, standardised by IUCr)
- CML (Chemical markup language)
- MOL (MDL Molfile)
- MOP (MOPAC format)
- PDB (Protein Data Bank)
- SDF (Structure Data File)
Chemical data may be distinguished in various ways, including Chemical MIME types.