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=134.73704470056086 stress="-7.494315521683861 -0.8608674706303362 -0.2728482426019867 -0.8608674706303362 -11.616832839977759 0.7824332700973055 -0.2728482426019867 0.7824332700973055 -7.291666198107139" free_energy=134.73704470056086 pbc="F T F" Pb 0.05473499 -0.12063495 0.13661615 -92.41592084 4.63380720 -85.22346288 Pb 1.40480033 1.28303047 0.11041876 66.48342659 8.24652096 -72.49598804 Pb 1.26735611 -0.16466555 1.24148635 94.62578027 10.59418753 84.90384079 Pb 0.08611608 1.53369179 1.52598936 -68.69328602 -23.47451568 72.81561013