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=1.8310973699642927 stress="-0.6851378493896372 -0.3216999121088996 0.4718293284067255 -0.3216999121088996 -2.579409777585722 1.0958851177951086 0.4718293284067255 1.0958851177951086 -2.474676948871003" pbc="F T T" Cu 0.22094491 0.23171545 0.18190327 -5.66733290 -8.08541948 -7.01028439 Cu 1.39217927 1.71219253 -0.07514625 0.36569329 -34.12706055 34.68665992 Cu 1.62990665 -0.21779550 1.78278197 12.06306137 35.31170193 -36.84245831 Cu 0.06210000 1.63362859 1.32702941 -6.76142175 6.90077810 9.16608278