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=227.72265211351305 stress="-26.06547858157771 -8.897226398905254 2.525467488527395 -8.897226398905254 -21.941493169368712 3.029891065736171 2.525467488527395 3.029891065736171 -13.500487644627913" free_energy=227.72265211351305 pbc="F T F"
U       0.04852473       0.35348325       0.13661615    -345.24028372    -139.41332265    -120.28449621 
U       1.40480033       1.15010476       0.11041876     347.44098438     199.37624874    -163.83144157 
U       1.26735611       2.71623631       1.24148635     196.93285621     -23.64457943     121.34084093 
U       0.08611608       1.53369179       1.52598936    -199.13355687     -36.31834666     162.77509685