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=11.76042343536856 stress="-2.411310388857558 -0.1486248914302054 -0.10248747862832486 -0.1486248914302054 -2.5398334994302494 0.6027455303723932 -0.10248747862832486 0.6027455303723932 -2.4555806969747893" pbc="T T F" Ni 0.05988540 -0.29754255 0.16431082 -15.92900956 32.19807989 -38.70360896 Ni 1.31425730 1.48844065 0.03277713 15.04995157 -13.14901809 -16.12663971 Ni 1.23068471 -0.12633864 1.46097674 19.48893662 15.50226161 19.14160356 Ni 0.00805869 1.71813893 1.26716069 -18.60987863 -34.55132341 35.68864511