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=6.927318103986519 stress="-15.633980602685916 -0.3114476761274638 -0.16235674146927792 -0.3114476761274638 -13.486067061143986 0.6684324459108844 -0.16235674146927792 0.6684324459108844 -16.45325825351528" pbc="F F F" Pb 0.15488783 0.05988540 -0.29754255 -5.52529744 -3.99134566 -5.51476585 Pb 1.66431082 1.31425730 -0.01155935 5.39202551 6.24880064 -4.13389912 Pb 1.53277713 -0.10028026 1.37366136 4.78494357 -6.08116737 5.26348148 Pb -0.03902326 1.28219307 1.71813893 -4.65167164 3.82371239 4.38518349