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=19.061808083023585 stress="-2.1766274529052887 -0.4151122460105728 -0.1872991255782196 -0.4151122460105728 -2.565511335597701 0.2331167303664015 -0.1872991255782196 0.2331167303664015 -1.9714558430196392" free_energy=19.061808083023585 pbc="F T F" Ni 0.04852473 0.01848935 0.13661615 -28.04544418 -2.56883657 -23.54930886 Ni 1.40480033 1.28303047 0.11041876 18.22269902 6.54576618 -19.59564987 Ni 1.26735611 -0.16466555 1.24148635 28.51637958 2.09920573 25.40745347 Ni 0.08611608 1.53369179 1.52598936 -18.69363441 -6.07613534 17.73750527