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=-6.585848849428055 stress="-0.6844252594780448 0.02935931127210314 0.0018526153610427284 0.02935931127210314 -0.5239383129390626 -0.010235065759510135 0.0018526153610427284 -0.010235065759510135 -0.6522583263092904" pbc="T T F" Ni 0.10338854 0.24759167 0.11018303 -2.28674540 -4.33512739 -6.41896959 Ni 1.17313584 1.24663523 0.18843096 2.52994477 4.90313118 -6.06337211 Ni 1.67061300 0.29169807 1.46863002 -0.69789002 -4.23406535 6.25263808 Ni -0.05369362 1.53851086 1.64982991 0.45469065 3.66606157 6.22970362