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=26.520912066311794 stress="-3.4930466740675254 -0.6504047483152107 -0.3211602770775211 -0.6504047483152107 -4.595943643073485 0.37416525872955675 -0.3211602770775211 0.37416525872955675 -3.1563615337201623" pbc="F T F" Pd 0.04852473 0.01848935 0.13661615 -45.19184524 -3.86333158 -37.90883740 Pd 1.40480033 1.28303047 0.11041876 28.97268049 10.26944441 -31.23737578 Pd 1.26735611 -0.16466555 1.24148635 46.05975002 3.27921986 41.00649960 Pd 0.08611608 1.53369179 1.52598936 -29.84058527 -9.68533268 28.13971358