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=32.302108891863 stress="-4.04231776167364 0.26849586939220793 -0.6065672605958661 0.26849586939220793 -4.363279798129867 -0.44819028087567464 -0.6065672605958661 -0.44819028087567464 -3.7077851402411737" pbc="T T F" Cu 0.23520322 0.24421963 0.09176916 -30.55706021 -13.52433783 -51.37750649 Cu 1.47635479 1.51477119 0.29553441 14.74173107 9.10091975 -35.26799988 Zr 1.34125301 0.00601457 1.20763472 31.50468445 -15.07026417 47.69351786 Zr 0.04910150 1.28901754 1.48006896 -15.68935531 19.49368225 38.95198851