16
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=59169.2924524982 stress="-2.9174505326743185 -0.6464862222040975 -0.4825542832585352 -0.6464862222040975 -3.373051240126016 0.46882253495500453 -0.4825542832585352 0.46882253495500453 -3.622416550646934" pbc="F F F"
Ra      20.82264626      20.91612709      21.21163425   -2015.50169819   -2510.53678232  -10251.71840700 
Ra      22.77614180      22.45458615      22.35915284  -24304.94485211   -5776.06942900    1731.83926661 
Ra      24.42636119      20.85195054      21.01938587   -9264.26375389  -19677.62069488  -19606.71363093 
Ra      25.39998200      22.28080881      22.48544640   28980.59741787   15123.05890759   12466.51756471 
Ra      20.76148242      24.19471510      21.07358198   -2861.20717819    -874.97298663   -3201.63702940 
Ra      22.34449728      25.44527504      22.78979294    7335.89849283   19173.00807359  -10809.76405722 
Ra      24.04215207      23.78681504      21.06760801    7948.81149422   17412.08942561  -28019.98382793 
Ra      25.41403500      25.40256623      22.32567180   12814.18233320   13939.09323136   -6963.52550719 
Ra      20.92614701      21.19899681      23.64823689   -4946.38530029   -4907.31839492   10515.93978245 
Ra      22.68061168      22.64900630      25.37951440    2601.96834122   -6764.42047092   23742.89801499 
Ra      23.87573638      21.15056515      23.95643769    6094.03839078  -26851.93238166   10960.50355334 
Ra      25.40639801      22.79878681      25.39461011   16080.56732159  -16232.43251385   17228.85062733 
Ra      21.23544721      23.82756440      24.01930693  -27297.16223725   -1622.96807461   -1873.91662481 
Ra      22.36876364      25.30999788      25.79563403     685.85817081    5877.00851492    5391.24113118 
Ra      24.25992344      24.20887594      24.01104098  -29383.37390778   -5865.68746251  -19453.32201952 
Ra      25.56646670      25.44479990      25.36497025   17530.91696520   19559.70103824   18142.79116338