Units = SI LengthUnit = 3.5 EnergyUnit = 100.0 MassUnit = 44.0 Simulation = MD Integrator = Gear TimeStep = 0.0001 Ensemble = NPT MCORSteps = 0 NVTSteps = 5000 NPTSteps = 20000 RunSteps = 200000 ResultFreq = 100 ErrorsFreq = 10000 VisualFreq = 0 CutoffMode = COM NEnsembles = 1 Temperature = 390.0 Pressure = 1.957 Density = 16.065 PistonMass = 0.0002 NParticles = 1372 NComponents = 1 PotModel = eox.pm MolarFract = 1.0 ChemPotMethod = Widom NTest = 500 Cutoff = 5.0 Epsilon = 1.0e10