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=11760.142018047083 stress="-1628.4226734992326 230.79827352424277 78.58145566709842 230.79827352424277 -1750.7093833234894 -902.0815099739373 78.58145566709842 -902.0815099739373 -2006.6444438619378" pbc="T F F" Lr 0.23666471 0.21840085 0.18912268 -2657.13928713 -29831.49680301 -35694.22887514 Lr 1.48003189 1.59243873 0.24890471 6036.45456401 9012.49468710 -6903.66913830 Lr 1.48882370 0.23017814 1.59285686 11373.66648535 -14459.71164508 8643.17473600 Lr 0.07889793 1.21208618 1.43959364 -14752.98176223 35278.71376099 33954.72327743