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=103.5028179382787 stress="-3.353864375568106 -0.03730444124473972 0.44637144334573187 -0.03730444124473972 -3.5685627196462386 0.40433617899824137 0.44637144334573187 0.40433617899824137 -6.909390243691958" free_energy=103.5028179382787 pbc="F F T"
Ca       0.29874826       0.05835534      -0.25354363     -32.01970647     -38.47735330       3.98727712
Ca       1.48193431       1.42001865       0.20070203      38.94818293      38.24300269     -13.02076587
Ca       1.20342959       0.28187239       1.36500085      39.12593736     -40.11441466       4.65993434
Ca       0.10170120       1.37793365       1.32947245     -46.05441383      40.34876526       4.37355441