612 Lattice="15.337147641664169 0.0 0.0 -7.668573820832085 13.282359479273762 0.0 0.0 0.0 35.481064396707175" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2129.0290899606857 stress="15.494472725657872 0.004432152797278377 -0.007683141719431852 0.004432152797278377 15.458816583166058 -0.030485816410360744 -0.007683141719431852 -0.030485816410360744 9.259325953170361e-05" pbc="T T F" Cu 0.00396504 0.00403114 0.04031757 -0.00000169 -0.00000815 0.00000018 Cu 2.56015632 0.00403099 0.04031749 -0.00000163 -0.00000613 0.00000029 Cu 1.28206072 2.21775765 0.04031750 -0.00000302 -0.00000746 0.00000011 Cu -1.27413049 2.21775766 0.04031760 -0.00000349 -0.00000730 0.00000008 Cu 2.56015444 1.47984131 2.08761846 -0.00000185 -0.00000554 -0.00000018 Cu 5.11634572 1.47984157 2.08761844 -0.00000076 -0.00000843 0.00000022 Cu 3.83825009 3.69356806 2.08761854 -0.00000315 -0.00000785 -0.00000058 Cu 1.28205878 3.69356789 2.08761849 -0.00000127 -0.00000511 -0.00000009 Cu 5.11634091 2.95564034 4.17844433 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