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=-1.2005890395279304 stress="0.07791565438173605 0.0022833847276781507 -0.013921149893939975 0.0022833847276781507 0.10560570377907502 0.009495786954961215 -0.013921149893939975 0.009495786954961215 0.08174154214698028" pbc="F T F" F 0.08331035 0.06500635 0.07544766 0.61638323 0.60985424 0.80334385 F 1.37533207 1.43285145 0.05430318 -1.10910603 -0.29279533 0.90159568 F 1.69087381 0.19522226 1.71526654 -0.46150748 0.22198165 -0.43174142 F 0.15789295 1.32972780 1.23785917 0.95423028 -0.53904055 -1.27319811