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:Z:I:1:forces:R:3 energy=-24.14094585765629 pbc="T F T" B 0.28433163 -0.24299512 0.06480817 5 2.64200870 8.98127347 -0.08695063 B 1.32960697 1.78737279 -0.15986018 5 -2.41454308 -9.17818367 0.36711075 B 1.22621882 0.27525869 1.47414171 5 -1.15969398 5.51160969 1.26433506 B -0.02503662 1.45609608 1.25129006 5 0.93222836 -5.31469950 -1.54449518