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=54.82173652452372 stress="-3.5353426921069704 0.18729487846109943 1.0901114388004631 0.18729487846109943 -3.032317893207976 0.6440305196546603 1.0901114388004631 0.6440305196546603 -5.01664004507554" pbc="F F T" Ar 0.29874826 0.05835534 -0.25354363 -36.07557321 -30.67989374 19.33293695 Ar 1.48193431 1.42001865 0.20070203 34.88773576 29.93982957 -17.62909017 Ar 1.20342959 0.28187239 1.51001192 49.38570280 -36.61113165 -8.08752275 Ar 0.10170120 1.37793365 1.21904386 -48.19786535 37.35119581 6.38367597