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:Z:I:1:forces:R:3 energy=74.0966666107 pbc="F T F"
Ca      -0.09481051       0.04044737       0.10459395       20     -31.19473092     -10.84499391     -23.80999580 
Ca       1.22286420       1.26954570      -0.02208018       20      21.14721268      16.76463820     -38.43232875 
Ca       1.65488783       0.35379734       1.20245745       20      34.21426591     -13.53014184      30.03746841 
Ca      -0.10954388       1.33528874       1.48844065       20     -24.16674767       7.61049756      32.20485614