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=-5.427059689294288 stress="-8.430373314403973 0.7694105001559582 4.2799721899468315 0.7694105001559582 -6.747453330296281 1.1351039605211928 4.2799721899468315 1.1351039605211928 -9.601792816817222" pbc="F F F" Cu 0.27500470 -0.13833825 -0.09601473 -1.07210933 -1.72979903 -0.95530745 Cu 1.28802619 1.72277084 0.18584377 5.49755026 2.52775609 -6.59989758 Cu 1.68362810 0.19581920 1.64685009 2.00652326 -2.35807562 1.73032924 Cu 0.26959405 1.67626233 1.35402479 -6.43196420 1.56011855 5.82487578