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=-14.293549718804345 stress="-0.5391085421416737 0.8912068691140093 -0.6559535808593394 0.8912068691140093 0.17205098206616612 -0.35441537039229154 -0.6559535808593394 -0.35441537039229154 0.7077385096221377" pbc="F F F" Ni -0.15318125 -0.13105901 0.04737131 -0.12453956 0.22839456 -0.09786003 Ni 1.53238783 1.74404962 -0.13189310 -0.28631894 -0.37932455 0.46706890 Zr 1.62937675 -0.24181915 1.59119645 0.56871166 -0.13323788 -0.08179909 Zr -0.20359122 1.71456242 1.77913633 -0.15785316 0.28416787 -0.28740977