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=-8.011203961562584 stress="-0.688386322182816 -0.06326420541313842 0.19360084854461257 -0.06326420541313842 -0.9108190907030524 -0.22158223011743022 0.19360084854461257 -0.22158223011743022 -0.7010050862124925" pbc="F F T" Ni 0.03926819 0.23010044 0.09566688 -4.61972732 -11.62391337 -7.49112229 Ni 1.62528982 1.62033173 0.17828948 8.61892981 6.65644026 -6.49224174 Ni 1.71182891 0.07255377 1.51129231 2.83062916 -5.12969623 3.20301478 Ni 0.01258782 1.66911338 1.30454100 -6.82983165 10.09716934 10.78034926