integrator               = sd 
tinit                    = 0
dt                       = 0.002
nsteps                   = 50000
init_step                = 0
comm-mode                = Linear
nstcomm                  = 10
comm_grps                = 
ld-seed                  = 1993

nstxout                  = 0
nstvout                  = 0
nstfout                  = 0
nstlog                   = 10000
nstenergy                = 10000
nstxout-compressed       = 10000
compressed-x-precision   = 10000
compressed-x-grps        = System 
energygrps               = C A B D 
cutoff-scheme = Group

nstlist                  = 10
ns_type                  = grid
pbc                      = xyz
rlist                    = 2.5

coulombtype              = Cut-off 
rcoulomb-switch          = 0
rcoulomb                 = 2.5
epsilon_r                = 1
epsilon_rf               = 1
vdwtype                  = user
rvdw-switch              = 0
rvdw                     = 2.5
DispCorr                 = EnerPres 
table-extension          = 1.0
fourierspacing           = 0.12
fourier_nx               = 0
fourier_ny               = 0
fourier_nz               = 0
pme_order                = 4
ewald_rtol               = 1e-05
ewald_geometry           = 3d
epsilon_surface          = 0

tcoupl                   = no
tc-grps                  = System
tau_t                    = 1.0
ref_t                    = 298.15
Pcoupl                   = no
pcoupltype               = isotropic
tau_p                    = 0.5
compressibility          = 4.5e-5
ref_p                    = 1.0
gen_vel                  = yes
gen_temp                 = 298.15
gen_seed                 = -1

constraints              = none
constraint_algorithm     = LINCS
Shake-SOR                = no
shake-tol                = 1e-04
lincs-order              = 4
lincs_iter               = 2
lincs-warnangle          = 30
morse                    = no

energygrp_excl           =