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=15.355783091041415 pbc="T F F" Cd -0.01203390 -0.15207737 0.16576063 48 43.82551387 -2.39481965 -53.23655590 Cd 1.66262133 1.48931954 -0.04934815 48 -9.12348900 7.47875995 -12.88441409 Cd 1.62959127 -0.28509741 1.33309145 48 -40.92024939 -9.46063294 54.47746638 Cd -0.02074151 1.70325214 1.50465723 48 6.21822453 4.37669263 11.64350362