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=-4.45086599895 stress="-2.7946666263308066 0.7756266697509885 -0.545967993735958 0.7756266697509885 -2.8788436090249485 1.4420887152160138 -0.545967993735958 1.4420887152160138 -3.704231299801122" pbc="F F F" Cu -0.11798803 -0.06699407 -0.27997518 -3.29834718 -3.12891096 -2.23176511 Cu 1.17059267 1.41661558 -0.03487808 -0.25255697 10.72627473 -11.51157003 Cu 1.72586561 0.29391194 1.22614529 8.70943723 -9.93240283 9.30096351 Cu 0.02103145 1.27761356 1.68220204 -5.15853308 2.33503906 4.44237162