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=-10.785361210922662 stress="0.6830817322611552 0.10120634432557972 -0.01228280884680034 0.10120634432557972 0.8912613681353033 0.3399299861459125 -0.01228280884680034 0.3399299861459125 0.6402583331399577" free_energy=-10.785361210922662 pbc="F T F" C 0.07034430 0.34727300 0.05473499 7.54731861 5.01964087 7.24500446 C 1.41561068 1.63661615 0.11041876 -6.41091628 2.22028959 5.95268618 C 1.26735611 2.83533445 1.24148635 -8.29712433 -4.74523872 -6.32230661 C 0.08611608 1.30660151 1.52598936 7.16072200 -2.49469174 -6.87538402