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=55.8336563198 pbc="F T F" Cd -0.00645191 0.33482998 -0.17480560 48 -144.47599380 -204.92483242 -282.45441839 Cd 1.46545771 1.04139603 0.27146889 48 329.22359483 175.37926797 -427.25763406 Ca 1.68947213 -0.09342029 1.63185401 20 606.30354502 -238.78367928 364.57211908 Ca 0.09364115 1.33058461 1.36537308 20 -791.05114605 268.32924374 345.13993338