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=-0.9590068859087583 stress="0.08295245136339373 -0.005847333822425376 -0.0002416908935355667 -0.005847333822425376 0.05516341800997629 0.005647214463046962 -0.0002416908935355667 0.005647214463046962 0.07966011087641374" pbc="T F T" user05 -0.09806662 0.15624558 0.13223516 0.06989853 0.54749916 0.35613094 user05 1.39964609 1.58000237 -0.06866258 -0.16999598 -0.46018536 0.14583475 user05 1.38959153 0.20500497 1.35409126 -0.21671039 0.57830294 -0.23279391 user05 0.13908428 1.45191304 1.33968423 0.31680784 -0.66561675 -0.26917178