4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=92.85760755034867 stress="-3.3042478252777774 0.2656137484288273 0.11832417760298491 0.2656137484288273 -3.6773646972639513 0.4271440685205887 0.11832417760298491 0.4271440685205887 -6.066294969338935" free_energy=92.85760755034867 pbc="F F T"
Sr       0.05835534       0.20070203      -0.29657041     -32.45478912     -31.30550911       1.11054979
Sr       1.40085166       1.49793547       0.28187239      32.81878732      35.27227663     -10.46548213
Sr       1.51001192       0.10170120       1.23292258      29.90662017     -36.27961139       7.54930281
Sr       0.00082602       1.74624097       1.49815252     -30.27061837      32.31284387       1.80562953