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=1669.4783479932028 stress="-271.1877160965742 50.07901900719133 18.0200884142006 50.07901900719133 -311.15794779471264 -28.482005049073152 18.0200884142006 -28.482005049073152 -268.6365153627027" pbc="T T T" Pd 0.00665521 -0.17622405 0.05522036 -2572.30040299 1974.03228321 -1566.66834633 Pd 1.24441287 1.61047581 0.25932425 3168.71902293 -2741.69294556 -3410.76802017 Pd 1.35045374 0.03976511 1.24023125 1521.32807039 1472.80985374 2931.86099313 Pd 0.04289471 1.56016831 1.51051609 -2117.74669033 -705.14919140 2045.57537336