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=-8.130810192080373 stress="-1.3722460978935285 0.07547588250130763 0.020341282284153658 0.07547588250130763 -1.3414095218104816 -0.048282206925498054 0.020341282284153658 -0.048282206925498054 -1.417603153212265" pbc="T T T" Ni 0.11042859 0.20947124 -0.14487149 -0.63244032 -3.36303175 -0.89609280 Ni 1.55280714 1.41333883 0.00144273 -1.75257699 1.55627331 -2.29268880 Ni 1.43229776 -0.17769156 1.41049160 -0.73777537 0.59359499 0.89544148 Ni -0.27713580 1.43858073 1.25205420 3.12279269 1.21316345 2.29334013