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=-8.093476308908398 stress="-3.1081099349538706 0.20345236682430645 0.5034215164198472 0.20345236682430645 -3.0108551816953457 0.34078144078570705 0.5034215164198472 0.34078144078570705 -3.520735709599826" pbc="F F F" Cu -0.00548572 -0.15873180 0.02506416 -0.92073592 -0.98510858 -0.38653939 Cu 1.31668137 1.41986395 -0.25603453 1.23205840 0.89385264 -1.89955304 Cu 1.59073906 0.27219963 1.43381326 1.04269298 -0.95775705 1.16165684 Cu 0.13132919 1.75978669 1.22592512 -1.35401545 1.04901299 1.12443559