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=63.16778433640713 stress="-1205.6575885359243 1.4285541895698515 -0.6955896379531623 1.4285541895698515 -1036.7005794460288 -203.63490586923194 -0.6955896379531623 -203.63490586923194 -1102.6479792101723" pbc="F F F" Ca -0.02335587 0.24122900 0.02201293 -519.66850150 -466.55603156 -531.88255244 Cd 1.31634348 1.42534241 -0.01433724 488.64819738 306.54610681 -355.58380074 Cd 1.31443107 0.04376171 1.22051529 485.26062828 -398.22516126 254.34206506 Ca 0.19273990 1.30722932 1.26172667 -454.24032415 558.23508601 633.12428812