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=4.811317879542925 stress="-1.763089513089005 -0.022985387215775446 0.2372807482850362 -0.022985387215775446 -4.370120273887865 -0.016989550994282013 0.2372807482850362 -0.016989550994282013 -1.540793723278882" pbc="F T F" Ni 0.28095696 -0.13608593 0.26008946 -17.66302118 -2.78195845 -20.79023643 Ni 1.37675974 1.11532290 0.28460712 23.04259816 2.51977007 -19.28134478 Ni 1.25346517 -0.15972173 1.27715687 18.93450886 -1.84930705 18.69879994 Ni 0.11893942 1.24086170 1.33885520 -24.31408584 2.11149544 21.37278128