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=-8.83750880483475 stress="0.568853742727168 -0.008035411732850687 0.031060027887906294 -0.008035411732850687 0.55342596144608 0.04637164398727017 0.031060027887906294 0.04637164398727017 0.7521819665096271" pbc="F F T" O 0.08859520 0.11535050 0.01759196 5.82765265 5.30538647 4.00881930 O 1.49838414 1.58295999 -0.18811966 -5.31887738 -4.27209806 2.91943285 O 1.48134915 0.15251273 1.14052315 -6.11198913 4.98270385 -3.24998875 O 0.20494637 1.58774231 1.09121987 5.60321386 -6.01599225 -3.67826340