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=423155.5790050046 stress="-2129357.212871768 -298746.28511063464 19068.7687414831 -298746.28511063464 -2580743.5084353704 -70196.60288932244 19068.7687414831 -70196.60288932244 -388106.16714419634" pbc="F F F" Ra 0.28167170 0.25653639 -0.06317113 -1117734.79584080 -1134540.37102796 -133138.13161004 Ra 1.42802814 1.46008567 -0.05457177 1094026.13868008 1147036.26739694 -84697.91688201 Ra 1.37094430 0.17226885 1.66209835 804952.14589948 -934617.72572407 71355.34697891 Ra 0.28371845 1.47272157 1.75090615 -781243.48873876 922121.82935509 146480.70151313