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=-2.172063078707083 stress="-0.7035511727082024 -0.12118982230970668 -0.045727734121876834 -0.12118982230970668 -0.5998800017521795 0.18096623646166862 -0.045727734121876834 0.18096623646166862 -0.650681294534285" pbc="T F F" Ni -0.00058651 0.09073906 0.27219963 -1.12333130 -5.73122678 -5.92978386 Ni 1.43381326 1.63132919 0.25978669 -0.31779138 8.54481886 -7.05305858 Ni 1.40782840 0.18365717 1.70288723 -1.82071450 -5.77541492 8.69093773 Ni 0.08343331 1.29585403 1.44809454 3.26183718 2.96182284 4.29190471