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=-3.945086537629554 stress="-25.062507742020784 -3.405098689033222 -3.0620591269502206 -3.405098689033222 -23.263714495026917 -4.033949051893786 -3.0620591269502206 -4.033949051893786 -26.404717155480462" pbc="F F F" Pd 0.08501927 0.06603388 0.00693356 -9.93612287 -9.93122141 -11.23372947 Pd 1.66501753 1.72580078 -0.07133680 7.81121478 6.61465430 -6.07674992 Pd 1.68883157 -0.00044125 1.54313966 7.47555223 -3.78778541 8.63517813 Pd -0.05167817 1.75980354 1.46667242 -5.35064414 7.10435252 8.67530127