32
Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=5986198.650672325 stress="-258.8291667694456 24.04523223506824 -52.36685281925261 24.04523223506824 -359.74592243858683 60.84935493303456 -52.36685281925261 60.84935493303456 -355.7729812112912" free_energy=5986198.650672325 pbc="F F F"
Ac      20.88909689      21.13714415      21.07420351 -614585.28687127 -1769892.25432472 -2384669.00783652
Ac      22.61543713      22.31143450      21.13708343   -4684.69557375  318720.32071501 -305911.67016155
Ac      22.06120567      20.89345311      22.38687053 1066505.76107967 -947998.13958053  358892.02701965
Ac      20.97882984      22.22221844      22.22919618 -572702.73736303 2548424.34237940 1848149.29541261
Ac      23.87472952      20.95894820      21.48446629   12102.71100451 -357403.06678184 -231450.67390710
Ac      25.57505321      22.19319283      20.96720332   97201.73913276   60372.75547290 -177494.55227924
Ac      25.28802619      21.22277084      22.68584377 -266606.61742988 -2334168.84471246 -2398850.38998233
Ac      24.18362810      22.69581920      22.52478374 -807042.96132779 -839231.25105457  185034.78733333
Ac      20.98863791      24.17708835      20.85402479  -26911.90613573 -114769.69169794 -156605.81415178
Ac      22.70996341      25.49207130      21.15300231 -504309.01888279  246882.08216549 -624567.79140459
Ac      22.78472413      23.95774659      22.56154559 -719962.03365536 -773857.05297433  -19554.99836278
Ac      20.81288230      25.38825682      22.38084462 -200781.50543327  561153.75600168 -268984.27322895
Ac      24.19178619      24.17895518      21.29140871 -1239029.29975884 -563951.62525738 -2438137.13622037
Ac      25.46968210      25.44587465      20.99560180  333305.39928699  356718.45910577 -142848.75760575
Ac      25.28091226      23.97850529      22.46603997 2314059.42722013  440177.45556986 1433489.10272557
Ac      23.80598025      25.32157598      22.51361598  718504.38526492 1556714.05364124 1005144.65719660
Ac      20.85198705      20.88616701      23.78616347 -464704.16576323 -204339.21602380  220105.88222989
Ac      22.37603515      22.03052278      24.14940211   -1654.26473109 8332413.79741571 -7866131.53629079
Ac      22.40115360      21.00571782      25.13093867  264014.66511281 -8329935.01279543 7908716.22974753
Ac      20.90830460      22.27674260      25.49045880 -200900.60807260  115707.24060646  140647.19370972
Ac      24.27219963      20.89478999      24.13132919 -662810.57184822 -435088.50982424  -37787.98917114
Ac      25.75978669      22.22592512      23.78504734 1246044.09190022 2395910.46811022 1850776.10844099
Ac      25.46585024      21.42102615      25.35059400 1051505.16263729 -537077.72903487  768412.66749663
Ac      23.98995639      22.27905951      25.60295688 -706358.85156561  530577.53717018  260395.03656900
Ac      21.23171545      24.11490920      23.54185980 -342000.69528220 -570290.50984886  507649.45840028
Ac      22.48915680      25.42485375      24.12990665   23449.95692584  602157.61146234 -387539.82970544
Ac      22.28220450      24.28278197      25.56210000 2153400.29934534 -2787796.16120638  502598.15761566
Ac      21.13362859      25.32702941      25.48695988 -2737513.93157450 2344535.68197611    6346.47144717
Ac      24.01364665      24.28060060      24.20952263 -1083079.95488804 -1076749.40213278 -1509138.69992983
Ac      25.36276144      25.40480033      23.89822649  526916.22965076  644270.61919488 -192218.42674733
Ac      25.29869006      24.11041876      25.26735611 1261679.44900520 -480216.62418149 1002150.87922324
Ac      23.83533445      25.24148635      25.58611608   86949.82859077 1068028.91044438 1143383.59241762