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=668.4083318254621 stress="-112.11347524190333 36.91193600846504 -34.084327710988966 36.91193600846504 -94.22075467719375 -17.308863662454865 -34.084327710988966 -17.308863662454865 -95.99975717787233" free_energy=668.4083318254621 pbc="T T T" Ar -0.14459490 0.11115480 -0.01275680 1129.87645749 -1231.65918945 -76.50749965 Ar 1.70960170 1.31143450 0.04092907 -1934.98383005 1157.74466787 -747.68514336 Ar 1.35333724 0.05786860 1.64041416 -116.89105422 -229.22345168 -207.18148780 Ar -0.22187219 1.51878885 1.32834452 921.99842678 303.13797326 1031.37413080