500 Lattice="13.177724226204305 0.0 0.0 0.0 13.177724226204305 0.0 0.0 0.0 13.177724226204305" Properties=species:S:1:pos:R:3:forces:R:3 energy=144560.46545247355 stress="-257.0228394243456 -1.0907803283170374 -0.2731371236826698 -1.0907803283170374 -256.36076313571243 0.8119859741283217 -0.2731371236826698 0.8119859741283217 -256.31063833232986" free_energy=144560.46545247355 pbc="F F F" Ar 0.04295757 0.04064726 0.02356843 -826.85384577 -841.37875358 -621.45967834 Ar 1.29428801 1.27624437 0.02648604 106.45838613 720.79761595 -988.81266322 Ar 1.30354983 0.01578277 1.37203527 194.61700075 -1382.11583270 -352.91169387 Ar 0.02512871 1.30833921 1.35000860 -1311.00934205 357.50363024 -239.30592319 Ar 2.54002104 0.02778185 0.04996581 337.53900793 -1007.51918497 -921.13003633 Ar 3.92767770 1.30750742 0.01710136 -22.69917070 164.23545878 -1289.23246485 Ar 3.91842269 0.05104072 1.28129064 160.10404110 -1515.92323617 238.05455143 Ar 2.66178554 1.31736002 1.37308080 -685.90254731 484.14994379 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