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=3.957149246540213 pbc="F F T" Zr -0.25204613 -0.17070544 -0.09358209 40 -18.63603815 -9.47556339 -2.48409481 Cu 1.39476746 1.37993804 0.28095696 29 21.45411035 35.03938810 -38.45101875 Zr 1.32464588 0.26008946 1.37675974 40 16.51965823 -35.43116296 32.93031203 Cu -0.17769535 1.78460712 0.98303456 29 -19.33773043 9.86733825 8.00480153