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=-5.6051929064725226 stress="-0.8786952287018679 -0.005301388217107482 0.08323016202132553 -0.005301388217107482 -1.048217853143721 -0.08333908977011513 0.08323016202132553 -0.08333908977011513 -0.824569984579495" pbc="F F T" Ni 0.10170120 0.00082602 0.24624097 -7.18488680 -10.56143849 -7.09317861 Ni 1.64302402 1.35498893 0.11042859 9.34813631 9.23452600 -9.17202221 Ni 1.70947124 0.05280714 1.41333883 6.06679015 -9.10907834 7.09176588 Ni 0.15488783 1.55988540 1.20245745 -8.23003966 10.43599083 9.17343493