HEADER

restart
temperature      293.00
pressure         0.0010
ensemble  nst hoover  0.1  0.3

steps            600000
equilibration         0
multiple step         5
scale                 1
print               100
stack               100
stats               100
rdf                 100

timestep         0.0010
cutoff           15.000
primary           6.000
delr width       0.5000
rvdw cutoff      15.000
ewald precision  1.0E-5
shake tolerance  1.0E-4
print rdf 
traj 100 100 3
eps              1.0000

job time            172000.0
close time           200.000

finish 
