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=-7.2970951702990385 stress="-0.8107678989689849 -0.1987344975676659 0.25432784358262805 -0.1987344975676659 -0.15646614097811218 -0.6905246954390539 0.25432784358262805 -0.6905246954390539 -0.3540422221573227" pbc="F F F" Cu -0.03624564 -0.09416457 -0.24440284 -0.22468730 -0.33730967 -0.26757960 Cu 1.20178472 1.79874826 -0.22709028 0.39601332 -0.05991970 0.04220697 Cu 1.38090187 -0.13863341 1.55835534 0.17330806 0.21978955 -0.15761207 Cu -0.25354363 1.48193431 1.42001865 -0.34463408 0.17743981 0.38298470