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=0.37198913833311 stress="-6.927499653936093 1.6721563030508961 0.7480822413852701 1.6721563030508961 -7.3842195694206865 1.1917022877582704 0.7480822413852701 1.1917022877582704 -7.026566730000851" pbc="F F F" Pd -0.08950840 -0.27713580 -0.06141927 -1.56689152 -1.04567075 -1.77499492 Pd 1.25205420 1.65488783 0.05988540 2.04532366 2.27281862 -3.49405897 Pd 1.20245745 0.16431082 1.31425730 3.47677498 -3.81018595 2.90663099 Pd -0.01155935 1.53277713 1.39971974 -3.95520712 2.58303808 2.36242290