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:Z:I:1:forces:R:3 energy=-3.4681103760034335 pbc="T F F" Ni 0.05988540 -0.29754255 0.16431082 28 -5.11922977 -3.78532437 -7.17485890 Ni 1.14522227 1.48844065 0.03277713 28 5.04433946 2.17894321 -9.04360976 Ni 1.39971974 -0.12633864 1.46097674 28 3.61165706 -1.08729760 8.27620512 Ni -0.21780693 1.71813893 1.26716069 28 -3.53676674 2.69367876 7.94226354