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:Z:I:1:forces:R:3 energy=642.554498305 pbc="T T T" Pd 0.01949998 -0.22458875 0.20194296 46 -135.78517116 -666.98776645 -568.93451795 Pd 0.97699235 0.99732680 0.07201244 46 148.08422656 587.44146869 -565.89254546 Pd 0.91936209 0.30421087 0.76291827 46 556.27139304 -453.47247701 622.63763163 Pd -0.17714137 0.51252696 0.85269921 46 -568.57044844 533.01877477 512.18943178