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=174279.73741158706 stress="-326821.81024302094 -141578.5487564163 3636.3837665093233 -141578.5487564163 -849654.7283630494 719700.7480399722 3636.3837665093233 719700.7480399722 -925294.4860289606" pbc="F F F" Pa 0.13734879 0.19228892 0.12020765 -182127.38688814 -49106.65550642 -122034.68814596 Pa 1.67285746 1.32644538 0.12907932 173107.75269044 736305.62164713 -728015.58656235 Pa 1.49403866 0.26482851 1.20227188 47880.44305779 -732379.87220213 818965.18608888 Pa 0.23887930 1.69060964 1.58651410 -38860.80886010 45180.90606141 31085.08861944