DL_POLY: PIMD Test Case: WATER
pimd nhc nbeads=35  nchains=3 taut=0.05
temperature       300.0
steps              5000
equilibration         0
timestep         0.0001
multiple              1
print              1000
stats                10
rdf                  10
print rdf
cutoff            7.241
delr                0.5
ewald precision   1.e-6
job time        18000.0
close time        100.0
finish

