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=-0.30342136309677414 stress="-33.50785391858013 5.911486691826782 -3.1846684180921905 5.911486691826782 -39.336487580988326 -12.146065506758557 -3.1846684180921905 -12.146065506758557 -34.89912294370474" pbc="F F F" Ni -0.23739624 0.12263099 0.04530481 -11.82278342 -14.62903919 -18.72504267 Ni 1.45206007 1.62593290 -0.15999292 7.18427872 4.62629064 -8.72685162 Ni 1.39901191 -0.08187355 1.20122014 16.44760570 -15.78901961 4.31830225 Ni 0.23212867 1.25294705 1.26067717 -11.80910100 25.79176816 23.13359203