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=2.2311764032274137 stress="-14.012768770339488 -0.17548014717186655 -0.04891314516584977 -0.17548014717186655 -12.876041851777957 -0.8463083152372599 -0.04891314516584977 -0.8463083152372599 -11.642135496878382" pbc="F F F" Pd 0.00082602 0.24624097 0.14302402 -4.50866770 -5.57963726 -6.30585854 Pd 1.35498893 1.61042859 0.20947124 5.11323818 4.81468346 -3.44233105 Pd 1.35512851 0.05280714 1.41333883 4.63705813 -4.12732622 4.11929139 Pd -0.15344509 1.37241235 1.32230844 -5.24162861 4.89228002 5.62889821