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=-0.5870679958871534 stress="-1.3798441539701438 -0.171420886161425 -0.45882678496967827 -0.171420886161425 -1.3693464957443635 -0.23653475181211706 -0.45882678496967827 -0.23653475181211706 -1.8168454210732063" pbc="F T T" Ni 0.14977756 0.09364432 0.27354104 -12.01297837 -6.69798031 -5.66473015 Cu 1.53273964 1.57675992 -0.11196580 14.95854016 -3.08904117 4.06604208 Cu 1.79497883 -0.20400199 1.31113270 11.29498613 4.99828944 4.34839901 Ni 0.29119256 1.30691229 1.66188986 -14.24054792 4.78873204 -2.74971094