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=30.510703391910035 stress="-5.205132528080348 -0.10622539610626668 0.10658796036922616 -0.10622539610626668 -3.878610932780234 -0.25164285473779296 0.10658796036922616 -0.25164285473779296 -6.001765011385813" pbc="T F T" Pd 0.03848316 0.19178619 0.17895518 17.13022531 -38.30227825 -18.15252702 Pd 1.79140871 1.61455359 0.03253581 -24.56681933 35.66124988 -4.50214104 Pd 1.64904689 0.10609294 1.46603997 -24.20368404 -41.95947016 10.19772036 Pd -0.19401975 1.32157598 1.51361598 31.64027805 44.60049853 12.45694770