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=-7.26249825973 stress="-0.9292719230817853 1.1234869406744865 0.4159770032030209 1.1234869406744865 -0.4327809631146329 0.2529000424017152 0.4159770032030209 0.2529000424017152 -0.7823511981096635" pbc="F F F" Cu -0.13833825 -0.13449789 -0.21197381 1.48088792 1.27170131 -0.35206736 Cu 1.72277084 1.68584377 0.18362810 -0.00916812 -0.56303078 -2.90441499 Cu 1.69581920 0.14685009 1.76959405 4.42528847 -4.13190444 1.04353396 Cu 0.17626233 1.35402479 1.74844657 -5.89700827 3.42323391 2.21294839