864 Lattice="21.44234925246262 0.0 0.0 0.0 21.44234925246262 0.0 0.0 0.0 21.44234925246262" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2772.8862838406203 stress="-25.837288574208095 1.998339051507429 0.5338635057587027 1.998339051507429 -26.5216387599734 -1.2471022184429899 0.5338635057587027 -1.2471022184429899 -26.63944326376253" pbc="F F F" Cu -0.00733055 -0.00515454 0.01158757 0.65433958 0.65157236 0.59416534 Cu 1.80075721 1.78348580 -0.02815232 -0.16349779 0.08532242 0.22138002 Cu 1.75414454 -0.00842448 1.79474930 0.23307020 0.17192991 -0.09211903 Cu -0.03368216 1.75671007 1.78996940 0.21760176 0.21313056 -0.08612917 Cu 3.58921937 -0.00499650 -0.02948910 -0.18151594 0.42420325 0.56511978 Cu 5.34750543 1.76487012 0.03417448 0.13800196 0.11783372 -0.37991541 Cu 5.37897621 0.02169689 1.76536531 -0.22121064 -0.31662688 0.18982954 Cu 3.56642665 1.81474656 1.76825399 -0.33320044 -0.36157876 0.20861538 Cu 7.17877530 -0.01784544 0.01553207 -0.02631620 0.47907153 0.30906282 Cu 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