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=2001.8364682935853 stress="-381.7946853399405 141.8660066612354 51.5802047473137 141.8660066612354 -310.8575630164715 20.532692869954325 51.5802047473137 20.532692869954325 -219.48832765173776" pbc="T F F"
Ca      -0.27571500       0.27038676       0.09418320    2152.25565201   -3662.38766663   -1821.54161723 
Ca       1.33376182       1.32291591       0.17777764   -1365.83977505    4528.78287440   -2464.28512771 
Ca       1.24832993       0.03355713       1.47087307    1050.59918689   -3303.33115104    2110.24992247 
Ca       0.06446997       1.43748823       1.57747979   -1837.01506385    2436.93594327    2175.57682247