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=81.09440853171253 stress="-8.066040748226726 0.8054305334281169 -0.3600474747713794 0.8054305334281169 -5.452988227208652 -0.034133684134711 -0.3600474747713794 -0.034133684134711 -5.0704230388740905" pbc="T F F" Pb -0.06254558 0.09073906 0.27219963 -12.14927845 -56.50306853 -59.75843208 Pb 1.43381326 1.63132919 0.25978669 11.60739104 42.63817956 -45.29638973 Pb 1.22592512 0.18365717 1.70288723 36.21831208 -58.29358120 50.25940963 Pb 0.08343331 1.29585403 1.44809454 -35.67642467 72.15847018 54.79541218