COLVAR_IAN: coordination of atoms documented by plumed
anion-product-sample-1.ener: the energy and temperature during the production run
anion-product-sample-pos-1.xyz: 20 ps production run, run with the Noose-Hoover thermostat
anion-product.inp: cp2k input file used for production run
anion-product.out: cp2k output file used for production run 
coordinates.xyz: input structure
plumed.dat: plumed input file
production-run.dcd: dcd-version of the production run trajectory 

