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=-5.607603798067569 stress="-7.377482655891022 6.467563705680165 3.032716178017896 6.467563705680165 -5.931542304470361 3.4997094362263947 3.032716178017896 3.4997094362263947 -2.911931528278994" pbc="F F F" Cu -0.29134056 -0.13449789 -0.21197381 1.00270544 0.70437040 0.78629241 Cu 1.71484213 1.64359035 0.18362810 0.83230795 1.39145360 -2.94107638 Cu 1.69581920 0.14685009 1.68811563 4.32085072 -5.44833867 1.22406550 Cu 0.17626233 1.35402479 1.66785677 -6.15586411 3.35251467 0.93071847