16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-60.928789039579556 stress="-32.441556704316106 -8.986575042877366 -0.47876220180097206 -8.986575042877366 -34.57968087713511 2.47863976805057 -0.47876220180097206 2.47863976805057 -31.940289613193094" pbc="F F F" Zr -0.18574270 -0.01155935 0.03277713 -1.79579884 -1.38178653 -2.14590331 Zr 1.39971974 1.37366136 1.46097674 2.61890598 5.44416907 -0.08932168 Zr 2.78219307 0.21813893 -0.23283931 1.80778584 -3.68846414 -2.06658894 Cu 4.71441271 1.51841841 1.38201197 -0.08699000 -0.25542415 0.96388344 Cu -0.04683655 2.59973259 0.05407955 -0.74874045 1.20881907 -0.78297887 Cu 1.41661558 4.34383310 1.72586561 -0.27231608 0.69992513 -1.55021597 Zr 3.04604271 2.72614529 0.02103145 0.47386812 3.21585002 -2.38390973 Cu 4.00886468 4.40044556 1.52978923 1.73534973 2.13589906 -1.27723500 Zr 0.23573857 0.02724172 2.77538150 -5.08638015 -5.49022508 4.00855168 Cu 1.20296332 1.11316561 4.67544234 1.23430782 0.56518289 1.16111970 Cu 2.78984966 0.06063367 2.92299150 1.79394660 -0.29347364 0.84164778 Cu 4.40698366 1.68107110 4.32825321 0.84675003 -1.22868232 0.50681078 Zr 0.13102478 3.09995250 3.46110479 -3.97892427 -2.35716173 -0.92670848 Zr 1.51193751 4.75226748 4.46431997 0.96230814 4.26673137 2.97952910 Zr 3.04396501 3.20197342 3.20379337 -2.04619553 -4.39776353 -0.61226237 Cu 4.73854596 4.26922180 4.15655554 2.54212305 1.55640451 1.37358188