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=10.388143582883007 stress="0.4577727828370393 0.05449927801957645 0.3158762350462868 0.05449927801957645 0.3832243629623137 0.2292435530334761 0.3158762350462868 0.2292435530334761 0.35741945730877367" free_energy=10.388143582883007 pbc="T F T" N 0.25452523 0.16501753 0.22580078 6.37807669 4.21452846 8.42607670 N 1.42866320 1.68883157 -0.00044125 -7.47467050 -2.61983791 -2.71025116 N 1.54313966 0.25980354 1.46667242 -7.48896960 3.83220843 -4.38802280 N 0.27143892 1.40295338 1.60338854 8.58556340 -5.42689898 -1.32780275