4 Lattice="3.5 0.0 0.0 0.0 3.5 0.0 0.0 0.0 3.5" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=94.47175692132845 pbc="T T T" Cu -0.00925081 -0.00152029 0.00395620 29 -52.95302378 -51.92216275 -52.16593068 Cu 0.87109090 0.86115429 -0.00034286 29 53.41320804 52.50497453 -52.98518666 Cu 0.86507926 -0.00991206 0.86354259 29 52.27288141 -52.80703036 51.35534884 Cu -0.00500850 0.85899784 0.88067119 29 -52.73306567 52.22421859 53.79576850