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=-6.626581079420906 stress="-0.33897759156278623 -0.00338334338694814 0.01798580555445228 -0.00338334338694814 -0.34576930482694695 -0.0077084145138120305 0.01798580555445228 -0.0077084145138120305 -0.3620910069614319" pbc="F T F" Cu 0.28278197 0.06210000 0.13362859 -3.57202189 -2.30530962 -3.65571032 Cu 1.32702941 1.31183065 0.04852473 4.42410311 1.72928211 -3.47478508 Cu 1.55473499 0.00172677 1.63661615 3.03650204 -1.11828848 3.02700591 Cu 0.11041876 1.26735611 1.33533445 -3.88858327 1.69431599 4.10348950