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=-3.8720182349206302 stress="-25.25671879315992 5.704838006764196 3.7027749946680046 5.704838006764196 -26.555282131124265 7.737339739907501 3.7027749946680046 7.737339739907501 -22.723525192364583" pbc="F F F" Ni 0.13572127 0.05791531 -0.26612504 -4.68619851 -4.62657553 -2.91487962 Ni 1.58501927 1.56603388 0.00693356 7.17261801 11.60383112 -12.01077386 Ni 1.66501753 0.22580078 1.42866320 10.15692652 -15.00602476 8.74666874 Ni 0.18883157 1.49955875 1.54313966 -12.64334602 8.02876917 6.17898474