Coordinates (PDB-format) for pdb2adf (within ADFinput, 'Protein' section)
- Oxidized plastocyanin from Synechococcus Sp.
- Pentapeptide Met-enkephalin (Tyr-Gly-Gly-Phe-Met)
- Methanol


Coordinates needed for other parts of the workshop
- 2,2-dimethyl-2-silapentane-5-sulfonate (NMR reference compound)
- Tetramethylsilane (NMR reference compound)
- Fe(III)-SH- coordinates for difficult SCF exercise
- Ar · · · Ar
- CH4 · · · CH4
- CH4 · · · NH3
- H2O · · · CN-
- HCl · · · HCl
- NH3 · · · NH3


Coordinates to be used only in case of emergency
- C20 cage
- Staggered ethane
- Iron(methylenediamine)3
- Water dimer (attractive)
- Water dimer (repulsive#1)
- Water dimer (repulsive#2)