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=71.7953289441 pbc="F F T" Cd 0.33114151 0.39778924 -0.19442371 48 -260.87903160 -530.86310191 38.00432268 Ca 1.54165967 1.72762461 0.19515918 20 716.81194315 528.63438528 -53.28024963 Cd 1.62876381 0.20422530 1.42314369 48 331.16280830 -414.34522967 82.04408127 Ca 0.31910254 1.40389038 1.38682613 20 -787.09571985 416.57394630 -66.76815432