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=-6.281549257922016 stress="-22.426643863166962 0.8672017070872882 -3.929191973155362 0.8672017070872882 -22.8203886593384 0.9042913593351471 -3.929191973155362 0.9042913593351471 -23.307070748411064" pbc="F F F" Ni -0.14801295 -0.02432459 0.06329927 -9.84250582 -6.58227970 -9.93525902 Ni 1.43745442 1.27846858 -0.00548572 5.30017595 8.60040494 -6.71906199 Ni 1.34126820 -0.15859300 1.31668137 9.64895709 -10.10682149 9.46360048 Ni -0.08013605 1.24396547 1.59073906 -5.10662722 8.08869625 7.19072053