32
Lattice="77.83913803100586 0.0 0.0 0.0 77.83913803100586 0.0 0.0 0.0 77.83913803100586" Properties=species:S:1:pos:R:3:forces:R:3 energy=-20.127388421779305 stress="-5.666853517738291e-05 2.7203851588439455e-06 -6.810158966227362e-08 2.7203851588439455e-06 -5.591104683257168e-05 -1.8153470375263482e-06 -6.810158966227362e-08 -1.8153470375263482e-06 -5.77714369314211e-05" pbc="F F F"
Ca      38.79907326      39.01219801      39.01160997      -0.18873347      -0.32529731      -0.36677506 
Ca      41.90228281      41.54240032      38.78484832      -0.22627497       0.68005327      -0.25846091 
Ca      41.52311819      38.78215048      41.83820783       0.24422217      -0.33748585       0.09858884 
Ca      38.73467553      41.71519561      41.55649200      -0.33817299       0.19161091       0.25587112 
Ca      44.14624957      38.88535918      39.08839727       0.40125964      -0.67518792      -0.25267984 
Ca      47.31367774      41.45675443      38.80748744       0.19163619       0.24395100      -0.31985899 
Ca      47.08283182      39.10521138      41.85440804       0.78428032      -0.98205909      -0.82375170 
Ca      44.63253087      41.86272090      41.79170861      -0.88998390      -0.07819743      -0.00143391 
Ca      39.14423072      44.62639272      38.79792300      -0.49602783      -0.50520095      -0.70951854 
Ca      41.79603726      47.25286941      39.04707094       0.15953609       0.64883967      -0.66881790 
Ca      41.52793849      44.44429627      41.63163954       0.82461024      -0.64275803       0.13027343 
Ca      38.88448015      47.16635734      41.50821826      -0.49862732       0.81650176       0.25899846 
Ca      44.63932927      44.62863676      39.16240961      -0.51091265      -0.63599439      -1.19087494 
Ca      47.35493799      47.28658984      39.04377476       0.30134330       0.42265285      -0.26670994 
Ca      47.07690354      44.56791823      41.67123821       1.24760635      -0.49340448       0.26324206 
Ca      44.31782432      47.11078998      41.71088488      -0.01049402       1.03535981       0.39066167 
Ca      38.79622489      38.89929853      44.53225684      -0.63291069      -0.39063792      -0.31628439 
Ca      41.64741692      41.51492871      44.47493601       0.40771874       0.68360510      -0.14148295 
Ca      41.56726173      38.78740818      47.10671114       0.49800013      -0.46834166       0.42185958 
Ca      38.85278897      41.48617612      47.33509255      -0.30137640       0.54862922       0.29082875 
Ca      44.70634047      38.86441340      44.34043571      -0.81411038      -0.50383875       0.49924194 
Ca      47.47596557      41.47114250      44.30038023       0.59516737       0.97926973       0.50211989 
Ca      47.41252430      39.08864170      47.32900442       0.23582528      -0.28999311       0.24741849 
Ca      44.55834269      41.65628368      47.44359742      -0.44553213       0.19732408       0.12148541 
Ca      39.11266523      44.63109351      44.14179469      -0.79338645      -0.51639193       0.63103256 
Ca      41.87636534      47.19685478      44.58776299      -0.16752516       0.83746390      -0.53882676 
Ca      41.51804198      44.71515909      47.31122666       0.39350506      -1.28107313       0.44587606 
Ca      39.03092617      47.11533451      47.31809691      -0.69564510       0.59070048       0.18472065 
Ca      44.51994472      44.52511994      44.40918302      -0.51861846      -0.70496238       0.09687749 
Ca      47.37332345      47.18014361      44.27792154       0.31512103       0.63279099       0.05595682 
Ca      47.09171838      44.57152308      47.06560675       0.69406282      -0.37898184       0.43338740 
Ca      44.34228615      47.04404862      47.33124006       0.23443720       0.70105340       0.52703522