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=-10.022666475399118 stress="-2.424261673636437 -1.2559473716722407 0.13211966818115561 -1.2559473716722407 -3.7080385950149 -0.5061323487339342 0.13211966818115561 -0.5061323487339342 -2.766507629571384" pbc="F F F" Ni -0.12280496 -0.20130994 0.11041876 -1.26409646 -2.11541572 -0.88768327 Ni 1.26735611 1.33533445 -0.25851365 1.09899667 1.32443160 -0.91629856 Ni 1.58611608 0.03369179 1.52598936 0.49488846 -0.24881345 0.76191656 Ni -0.27670350 1.46375436 1.40583543 -0.32978866 1.03979756 1.04206527