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:Z:I:1:forces:R:3 energy=7.88246520344 pbc="T F T" Cu 0.12418668 -0.09051133 0.19462846 29 -15.29230485 -20.12788255 -14.58346819 Cu 1.16337955 1.27846858 0.17817145 29 19.63436934 22.90357369 -22.91839632 Cu 1.42470151 0.06235191 1.31668137 29 16.77087189 -19.87111756 17.65714185 Cu 0.15157940 1.24396547 1.41257404 29 -21.11293639 17.09542641 19.84472266