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=-1.3614234269905454 stress="-1.0019265247826614 0.05968676506956756 0.006000328395787564 0.05968676506956756 -0.9174193758238679 -0.014311886336505444 0.006000328395787564 -0.014311886336505444 -0.8352468977460679" pbc="T F F" Cu -0.14801295 0.06329927 0.09073906 5.77095013 -11.15324148 -7.99907586 Cu 1.77219963 1.43381326 0.13132919 -6.94975629 9.51411249 -7.41070131 Cu 1.75978669 0.18365717 1.70288723 -5.80855118 -8.73117246 7.59802854 Cu 0.08343331 1.29585403 1.44809454 6.98735734 10.37030145 7.81174863