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=-2.5533105712702953 stress="-1.1604531917914978 -0.10059993311450706 -0.21426945558641974 -0.10059993311450706 -0.9686157896651403 0.2578024901291637 -0.21426945558641974 0.2578024901291637 -1.2864401292029015" pbc="T F T" Cu 0.29391194 0.02103145 -0.04131534 -7.17612159 -6.75644246 -5.92425928 Cu 1.68220204 1.39362841 0.23573857 -0.32537394 13.25411336 -13.55990618 Cu 1.35549493 0.22083292 1.28984966 6.11732237 -14.19907984 13.03023005 Cu -0.01264569 1.42299150 1.40698366 1.38417315 7.70140894 6.45393540