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=58.24504890001725 stress="-217.13340875007594 58.72272891896249 14.96536416714045 58.72272891896249 -268.8635709616615 87.24669477167686 14.96536416714045 87.24669477167686 -285.35160553047444" pbc="F F F" Pd 0.05971573 0.12678487 0.14552962 -47.59374605 -53.65619926 -50.54319055 Pd 1.68107110 1.32825321 0.13102478 55.53345086 118.87184481 -155.24700604 Pd 1.59995250 0.26120756 1.51193751 95.43977478 -177.26608487 146.26558668 Pd 0.25226748 1.46431997 1.54396501 -103.37947959 112.05043932 59.52460991