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=859.0240554433169 stress="-0.015689986640475835 0.00013690595234540863 -0.0007124264853053029 0.00013690595234540863 -0.014713885722952699 -0.0004708533983413565 -0.0007124264853053029 -0.0004708533983413565 -0.015732313816563218" free_energy=859.0240554433169 pbc="F F F"
In      20.85540510      21.11115480      21.11044915     -20.66162174     -26.57264354     -30.39472881
In      22.70960170      22.34512630      20.83833517      -6.00695139       5.66113111     -28.72386606
In      22.31428531      20.83509776      22.36371066      -1.62064071     -29.91411852       1.14837990
In      20.77812781      22.48254321      22.23417995     -26.55960447      11.86773613      11.66353529
In      23.87679405      20.95894820      21.20259391       8.88580739     -32.89781051     -20.86778630
In      25.56504129      21.96425659      20.86550211      22.75080720       1.08565266     -25.75489439
In      25.28802619      21.22277084      22.68584377      19.95858891     -64.10248341     -47.49871926
In      24.18362810      22.69581920      22.64685009     -20.86095629     -24.77897779      -6.68479331
In      21.26959405      23.87804706      20.85402479     -16.26457580       1.65731138     -29.54501205
In      22.70996341      25.49207130      21.15300231     -13.61672765      29.10201311     -39.55779370
In      22.53848316      23.95774659      22.71726984     -22.10354578     -11.55780538     -13.84621657
In      20.95789336      25.38825682      22.04332575     -27.44300067      22.94934837       3.22239922
In      24.19178619      24.17895518      21.29140871     -14.90941104     -13.05605505     -77.94695143
In      25.61455359      25.53253581      21.14904689      21.62760384      22.12166370     -17.83894015
In      25.28091226      23.98699481      22.46603997      78.11142344       4.41125415      10.80746093
In      23.80598025      25.32157598      22.51361598      12.12843348      61.29062556      10.77314541
In      20.85198705      20.97567541      23.92466586     -32.26371108     -20.69943745      -0.15434800
In      22.49580977      22.02492495      23.97644859      -1.35463021      11.01475727      -7.34740711
In      22.26128685      20.84140700      25.31668137      -3.65603359     -38.16351472      31.14452677
In      20.91986395      22.44466750      25.59073906     -21.52705628      -0.42704222      19.31436682
In      24.27219963      20.93381326      24.13132919      -9.23735846     -33.48601690      17.92174637
In      25.75978669      22.22592512      23.78504734      50.82527914      35.18006848      44.06016046
In      25.68365717      21.20288723      25.58343331      15.65746121     -10.44521863      21.72871821
In      23.49928362      22.34894620      25.72094491      10.78443943       1.90703282      29.49000407
In      21.23171545      24.17983874      24.10370736     -44.63833087      -8.62599460     -15.24680372
In      22.71219253      25.42485375      24.13991858     -15.12904345      52.77917929      -6.90390809
In      22.28220450      24.28278197      25.56210000      31.88838227     -48.79833305      43.98587295
In      21.13362859      25.32702941      25.57034430     -61.56520222      60.40111194      25.33640598
In      24.03305812      24.15643619      23.91561068       5.93006809     -13.30527611      21.87103569
In      25.63661615      25.40480033      23.75512869      28.34216110      30.94295161       6.71257529
In      25.29869006      24.11041876      25.26735611      34.62337106      -8.54336487      30.26594853
In      23.83533445      25.24148635      25.58611608      17.90457514      33.00225517      38.86588709