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=-9.630985291128571 stress="-10.510605783071698 -2.4748425666893183 2.0708514441980777 -2.4748425666893183 -9.7227428322678 -0.6920408528560062 2.0708514441980777 -0.6920408528560062 -9.376607784819917" pbc="F F F" Ni 0.29874826 -0.22709028 -0.11909813 -2.96677220 -4.53895028 -2.96727244 Ni 1.36136659 1.55835534 0.02832876 5.35222272 4.24920221 -3.06731743 Ni 1.48193431 -0.06996943 1.70070203 2.17421762 -1.13156541 2.48527346 Ni -0.19486921 1.40085166 1.37586912 -4.55966814 1.42131349 3.54931641