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=-5.350471764697146 stress="-0.49328498106038854 -0.06469528873221869 0.03770503799330351 -0.06469528873221869 -0.5081637498689497 -0.07871233004378718 0.03770503799330351 -0.07871233004378718 -0.5273232736887143" free_energy=-5.350471764697146 pbc="F T F" Ni 0.28278197 0.06210000 0.13362859 -5.04579012 -2.57543165 -5.23478130 Ni 1.32702941 1.31183065 0.04852473 6.51779550 0.92604022 -5.17411846 Ni 1.55473499 2.63890718 1.63661615 4.33338942 0.73671692 4.27824261 Ni 0.11041876 1.26735611 1.33533445 -5.80539481 0.91267451 6.13065715