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=10.660011940314645 stress="-2.2108512413468673 -0.15733667106559132 0.041027239228781605 -0.15733667106559132 -3.845885372596408 0.12815969016105044 0.041027239228781605 0.12815969016105044 -2.182672106141334" pbc="F T F" Ta 0.05473499 -0.12063495 0.13661615 -26.33541147 0.84016546 -24.26181493 Ta 1.40480033 1.28303047 0.11041876 21.42089856 1.15076707 -22.56290465 Ta 1.26735611 -0.16466555 1.24148635 25.92119073 2.33395157 23.60591307 Ta 0.08611608 1.53369179 1.52598936 -21.00667783 -4.32488410 23.21880652