108 Lattice="7.907282982004972 0.0 0.0 0.0 7.907282982004972 0.0 0.0 0.0 7.907282982004972" Properties=species:S:1:pos:R:3:forces:R:3 energy=2197.765707081705 stress="-9.30986674880066 -0.02095807510894049 -0.01389900696540091 -0.02095807510894049 -9.307285280272373 0.012272423264860496 -0.01389900696540091 0.012272423264860496 -9.298281660979477" free_energy=2197.765707081705 pbc="F F F" Ar 0.04504773 0.01962624 0.00473896 -25.48050578 -22.49138674 -23.37223045 Ar 1.36079653 1.30007715 0.03443979 -6.81595424 8.05636269 -50.43883376 Ar 1.34385369 0.04368085 1.28639293 -4.54557153 -51.94894610 5.87631202 Ar 0.04531885 1.34621274 1.35793699 -54.92906526 -1.92051866 -6.84315185 Ar 2.62653129 0.04205021 0.03176126 5.44379776 -41.12111285 -40.40405087 Ar 3.92171200 1.36315439 0.00095900 9.13164764 -9.70022464 -46.95367882 Ar 3.93713866 0.02522419 1.34957727 5.39798701 -49.02134887 -11.06559466 Ar 2.65366606 1.28091066 1.28203123 -0.13449579 10.14395537 7.72273444 Ar 5.31996968 0.00710394 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