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=6.07725487695468 pbc="F T F" Zr 0.27143892 -0.09704662 0.10338854 40 -41.04195564 7.07547523 -27.23956511 Zr 1.74759167 1.61018303 -0.07481803 40 26.34091806 -8.07770664 -10.01989693 Cu 1.24663523 -0.01297511 1.44857885 29 32.62493173 20.26655139 25.34034997 Cu 0.18843096 1.67061300 1.79169807 29 -17.92389415 -19.26431999 11.91911207