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=-12.737788823559058 stress="-0.17604545135886593 0.04838395443454971 0.07624960892475023 0.04838395443454971 -0.1694106284637054 0.024266773760833044 0.07624960892475023 0.024266773760833044 -0.21446821893040952" free_energy=-12.737788823559058 pbc="F T F"
C       0.13661615       2.90480033       0.11041876      -1.27294419      -1.84673897      -0.71637365 
C       1.26735611       1.33533445       0.08611608       2.64326887       2.73776175      -3.93020407 
C       1.53369179       0.02598936       1.22329650       1.60861724      -3.44760709       1.32146910 
C       0.29874826       1.27290972       1.38090187      -2.97894192       2.55658431       3.32510862