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=-7.384033864440839 stress="-8.795268963297222 0.13467328825427027 -1.6599131177485407 0.13467328825427027 -16.02626962589689 -6.846639218604504 -1.6599131177485407 -6.846639218604504 -14.864862246026735" pbc="F F F" Ni -0.14459490 0.11115480 0.11044915 -3.45671725 -8.67273898 -9.27205077 Ni 1.70960170 1.31143450 0.04092907 2.62234818 2.26884689 -1.82704482 Ni 1.28829595 -0.16490224 1.64041416 2.64698848 -2.54719062 3.91037343 Ni -0.22187219 1.51878885 1.32834452 -1.81261941 8.95108271 7.18872217