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=3.534660457928596 stress="-80.22552606163883 30.66992408846756 -4.262059452725595 30.66992408846756 -51.017026689767135 -4.850915706489495 -4.262059452725595 -4.850915706489495 -33.802205852420855" pbc="F F F" Pd 0.00505582 -0.26405180 0.17858111 -10.14792788 -14.82854054 -11.27931233 Pd 1.40480996 1.34376228 -0.23179438 6.40682847 8.78355958 -8.49538358 Pd 1.45203735 0.26111147 1.72232616 48.44893669 -29.06696425 11.31435575 Pd -0.02072992 1.22147108 1.69736496 -44.70783728 35.11194520 8.46034016