64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=18376.282286404978 stress="-0.1986053129307923 -0.017127661116209062 -0.04636951137800982 -0.017127661116209062 -0.2537987165673585 0.03698687999943229 -0.04636951137800982 0.03698687999943229 -0.19312474540368046" free_energy=18376.282286404978 pbc="F F F" Ar 34.83451651 35.10535810 35.39397009 -1063.76782886 -470.25827587 -319.71575892 Ar 36.33268130 35.76741069 35.84410269 1018.07542531 453.04720674 281.01695836 Ar 36.64919348 37.61204406 34.82226869 4.62750803 47.62189307 -34.93919930 Ar 37.98134164 39.07917266 36.28232034 97.38300319 -121.69750347 -314.24667554 Ar 37.24217325 34.85297404 37.47687593 -1085.44213440 -975.13515488 -732.47226960 Ar 38.35961812 35.78492223 38.26964376 1076.90708230 934.41333821 751.85753840 Ar 35.05236494 37.39055695 37.67204097 -4.67646194 0.07152206 -3.20122906 Ar 36.55604684 39.07636534 38.99475015 -12680.48027989 23143.12596927 -11868.72110910 Ar 40.70088882 35.54050247 34.99882356 -8.65795307 -7.38401576 -16.33370709 Ar 41.66337300 36.36674795 36.94832907 -301.05221454 288.23230395 -117.43018128 Ar 42.86277397 37.52887429 35.13407940 -499.90186246 -673.28002862 -662.20766256 Ar 43.67164286 38.61541692 36.18479006 507.91453723 673.36181558 652.54486012 Ar 42.93908890 35.17473801 37.50606904 146.72946957 -497.02720015 -113.65331040 Ar 43.78110695 36.23326230 38.78594819 490.06712717 -46.84566975 -239.64917345 Ar 39.69020290 37.57777497 37.77741105 -50.51823382 -19.31594923 -58.02708198 Ar 41.02074724 38.51099541 39.05570660 74.81065392 33.68568648 35.03743521 Ar 34.69377201 39.99586385 35.35582450 -9.76127942 -6.19722616 -7.21274103 Ar 36.36826737 41.12442926 36.63175822 -11.14161718 -52.75074801 -5.52179065 Ar 37.29345274 42.29085015 35.09374850 -14.17148051 1.05685552 -81.11324053 Ar 38.61643991 43.32327578 36.40123177 -9271.20847723 5710.96761332 -6278.80556655 Ar 37.49628893 39.73932125 37.95902960 2347.24883777 1809.96712941 -2378.29375470 Ar 39.14193657 41.14159098 38.05157904 -51.43514979 -239.03071326 158.37233810 Ar 35.57718541 42.76939185 37.70660126 -10.09878550 -70.03259302 -231.22701755 Ar 35.46670815 43.56634079 39.42105497 -29.24133324 152.28863130 243.00889463 Ar 40.62134983 40.36716718 34.90225128 -23.36541141 -24.73207094 -42.35897607 Ar 41.55001050 41.34881552 36.57847405 -3796.19311999 3231.80321245 -3068.01608472 Ar 42.03909150 43.34588795 34.73563332 -9.40605186 -2.31511387 -12.39273132 Ar 43.55875820 43.93086425 36.45407384 9.92100050 3.97511890 11.00564133 Ar 42.52861623 40.52701693 37.37163078 3639.28710704 -3375.25257794 2861.01743233 Ar 43.53760724 41.38896908 38.68453127 352.80131443 -32.33878297 135.70833585 Ar 39.66448343 42.68403127 37.11226018 9320.39155157 -5423.33017169 6050.99969756 Ar 40.71516120 42.93281997 38.81358906 -328.62935724 71.28700815 -38.85841420 Ar 35.49133878 35.41385920 39.50427763 -1294.07818892 -5569.26379932 -5743.43394352 Ar 35.72537574 36.42200066 40.54480565 1270.89810032 5545.31691936 5756.14001838 Ar 37.00297454 37.99791377 39.62151619 10357.03463516 -24929.51854197 14490.74691968 Ar 38.78243708 38.51836867 41.81092657 -1393.06187719 -1151.61805640 1871.74089901 Ar 36.72507306 35.26357726 42.58695412 -59.49813465 -20.88386302 -21.54516428 Ar 38.60175368 35.82109747 43.37957487 44.89472781 4.46366258 35.81044832 Ar 35.19188989 38.43113208 42.68280383 -21664.08470407 -12502.45981961 -12913.27960327 Ar 36.21823021 39.02325150 43.29514912 5308.11507732 -6277.54493251 27813.02588939 Ar 39.49937938 35.22198360 39.97615061 30.16183991 -18.27097269 47.88763995 Ar 41.48837336 36.00831489 41.43404765 -3169.62295842 5096.70237183 -2767.36371736 Ar 42.87610597 36.93808096 40.15118991 -1340.20361468 -3752.34184200 -3319.13833313 Ar 43.16214879 38.02171062 41.16224051 1068.73895556 4032.64575448 3763.35833749 Ar 42.20384740 34.85081933 42.03810700 3229.07676910 -5228.96548626 2726.58488907 Ar 43.86711865 36.22502115 43.65084414 1.79599531 1.22680582 1.90325062 Ar 40.22865493 37.14039452 42.44921816 -74.41348297 -77.75494032 -40.86543214 Ar 40.58029149 38.47117941 43.82796402 38.36279769 136.39307852 144.24023508 Ar 35.12004424 40.00042707 40.00682194 -131.55592140 -12.23732498 39.05868599 Ar 35.46449589 41.83541913 40.87433342 898.65901827 -1284.23062092 -1622.19353264 Ar 37.49308810 42.33652103 39.54899916 -29.67456121 -47.07626323 -75.39937946 Ar 38.44716409 43.23465428 41.12953737 39.75746217 48.44463641 74.04181110 Ar 36.96786264 39.88429939 42.61156932 16345.76920927 18786.54210584 -14894.47517092 Ar 39.41085560 41.10936237 43.54917825 -72.98656466 -72.93836134 105.71708726 Ar 34.84911262 42.76766083 42.04035502 -894.41800355 1344.42643302 1682.61435595 Ar 36.41851943 43.83337009 43.68242222 4.34096312 2.98360468 4.67346478 Ar 39.60675953 39.24865510 40.64950065 1324.38920931 1195.80915240 -1882.88821908 Ar 40.89974943 41.22892384 41.12165250 3664.44045783 -6469.11359171 -7429.46215846 Ar 42.42514645 42.72433644 39.45486603 236.70294272 145.56819029 257.58481715 Ar 43.90918678 43.68770482 41.32374220 2.86458783 1.92607609 3.58001820 Ar 42.89864609 40.36253528 42.01114327 -16.89641253 -49.65249921 -91.72148858 Ar 43.43271795 41.23545638 43.76561610 30.60588587 49.88415872 100.46780235 Ar 40.39757659 42.11536967 42.13716159 -3593.54136169 6552.64440334 7325.58488924 Ar 41.35328338 44.02988149 43.99820222 0.41156570 0.91205332 0.83322754