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=18.171568874190985 stress="-66.15078809899043 8.37490755962476 -18.332269273444048 8.37490755962476 -54.241335714626594 -9.088868136241395 -18.332269273444048 -9.088868136241395 -73.0728191035464" pbc="F F F" Pd 0.19178619 0.17895518 0.29140871 -30.32676950 -24.50660122 -50.05183816 Pd 1.61455359 1.53253581 0.14904689 12.41903924 15.94545277 -10.03904556 Pd 1.28091226 0.10609294 1.46603997 37.55447182 -18.82028185 37.83151731 Pd -0.19401975 1.32157598 1.51361598 -19.64674156 27.38143031 22.25936641