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=-2.9252916995078317 stress="-1.6120313015408316 0.002010122477408192 0.06799168308431534 0.002010122477408192 -1.7375671153529628 -0.45057345370203766 0.06799168308431534 -0.45057345370203766 -1.6701264155553024" pbc="T T T" Ni 0.00082602 0.24624097 0.14302402 -8.27921637 -17.30912918 -21.09106593 Ni 1.35498893 1.61042859 0.20947124 10.23539510 3.91159098 -16.76054049 Ni 1.35512851 0.05280714 1.41333883 8.57929267 -4.06274213 13.83348376 Ni 0.00144273 1.37241235 1.32230844 -10.53547140 17.46028033 24.01812267