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=-4.95649577329 stress="-3.2097728218779307 -1.0679636286343892 1.019391903736746 -1.0679636286343892 -4.145219260985155 -1.341603714926536 1.019391903736746 -1.341603714926536 -3.760123499271511" pbc="F F F" Ni 0.22094491 0.23171545 0.18190327 -6.50485592 -13.06830727 -7.74384928 Ni 1.32183498 1.71219253 -0.07514625 9.45231236 6.08175216 -5.64771873 Ni 1.54551734 -0.08117935 1.68758231 2.82732018 -0.38560897 2.39930894 Ni 0.06210000 1.63362859 1.32702941 -5.77477663 7.37216408 10.99225907