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=404.8397062797415 stress="-1966.696733921102 -97.37995746206923 -485.87748700029533 -97.37995746206923 -1492.2028294081304 70.93377295269977 -485.87748700029533 70.93377295269977 -2149.5673870851097" pbc="F F F" Pd 0.25573646 0.00923921 0.28345050 -890.82734381 -707.44499888 -789.75574685 Pd 1.75367537 1.25124039 -0.08005391 393.87642319 603.76514839 -680.81855553 Pd 1.59332949 0.29975156 1.57192302 951.96896433 -500.71251173 1175.74336927 Pd 0.02860952 1.47813430 1.59665676 -455.01804370 604.39236222 294.83093311