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=34.5250384251302 stress="-161.33459728113823 55.160984691570214 3.74397932700694 55.160984691570214 -140.0221016235606 9.23973519942561 3.74397932700694 9.23973519942561 -108.34435710211007" pbc="F F F" W 0.23171545 0.18190327 -0.17816502 -30.27999247 -27.13758899 -35.33090889 W 1.71219253 1.42485375 0.12990665 38.84207205 39.93185577 -32.58393941 W 1.28220450 0.28278197 1.56210000 89.66753642 -100.58902508 44.53980796 W 0.13362859 1.32702941 1.57034430 -98.22961599 87.79475829 23.37504035