4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=54.8229587334711 stress="-3.535342677907359 0.18729487938248573 1.0901101542115084 0.18729487938248573 -3.0323200012040883 0.6440272351855638 1.0901101542115084 0.6440272351855638 -5.0167252167002365" free_energy=54.8229587334711 pbc="F F T" Ar 0.29874826 0.05835534 -0.25354363 -36.07557794 -30.67992595 19.33287084 Ar 1.48193431 1.42001865 0.20070203 34.88773171 29.93984420 -17.62905562 Ar 1.20342959 0.28187239 1.51001192 49.38570837 -36.61114423 -8.08752273 Ar 0.10170120 1.37793365 1.21904386 -48.19786214 37.35122598 6.38370751