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=-5.405957045318205 stress="-4.0729257239355565 1.2977133295061574 -0.13317462662756663 1.2977133295061574 -6.089611127733629 1.2758115475848566 -0.13317462662756663 1.2758115475848566 -7.2801445910582085" pbc="F F F" Ni -0.25271761 -0.01806569 0.16625962 -0.79983767 -1.58621850 -1.42458344 Ni 1.70070203 1.20342959 -0.09914834 0.72216647 1.87582242 -3.42494197 Ni 1.49793547 0.28187239 1.51001192 1.74692768 -3.23329335 3.74848749 Ni -0.01546661 1.60170120 1.37793365 -1.66925648 2.94368943 1.10103791