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=-6.823507119295926 stress="-5.706385698590047 -0.6786904005870629 -1.5561221059375812 -0.6786904005870629 -5.715006839033002 0.2538777443619553 -1.5561221059375812 0.2538777443619553 -6.072716455674231" pbc="F F F" Ni 0.04396501 0.07236142 0.20379337 -2.92462375 -2.42568046 -2.27631613 Ni 1.73854596 1.26922180 -0.21770305 1.37871631 1.80511180 -1.84596943 Ni 1.52031036 0.18745344 1.52015752 2.26893047 -1.57053731 3.19061083 Ni 0.01586859 1.77711528 1.37871118 -0.72302304 2.19110597 0.93167473