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=-6.57196407777 stress="-0.9037128404588266 -0.3665060177926221 0.04306703402613916 -0.3665060177926221 -1.2890948722331965 -0.16198407327465406 0.04306703402613916 -0.16198407327465406 -0.9827490670194136" pbc="F F F" Cu -0.12280496 -0.20130994 0.11041876 -2.37783287 -3.93319215 -1.71148839 Cu 1.26735611 1.33533445 -0.25851365 2.07800188 2.47607159 -1.82908078 Cu 1.58611608 0.03369179 1.52598936 1.16197795 -0.63731504 1.52939415 Cu -0.27670350 1.46375436 1.40583543 -0.86214696 2.09443560 2.01117502