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=570065.289283229 stress="-90972.66699116069 32276.384414038777 -27596.412778188344 32276.384414038777 -83341.29079794456 -10494.311433388228 -27596.412778188344 -10494.311433388228 -80968.6957722769" pbc="T T F" Pm -0.23960211 0.28186809 0.00371596 842730.71173108 -943534.61992348 -625834.46299574 Pm 1.77121628 1.46174056 0.47782369 -1825506.89495429 1114987.16566057 -1102298.30512699 Pm 1.58205704 -0.02475557 1.46797137 -297598.51199876 -214536.24823340 397153.13391393 Pm -0.13763167 1.27511925 1.60195928 1280374.69522198 43083.70249631 1330979.63420880