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=31.343403342867408 stress="-137.14149392600893 -10.411498689950463 -32.547744873767506 -10.411498689950463 -221.27846013660633 117.75339962901295 -32.547744873767506 117.75339962901295 -205.3499006305853" pbc="F F F" In -0.14209323 -0.25870578 -0.06557663 -49.26706368 -20.08364946 -46.94384288 In 1.75346659 1.68496642 -0.04191911 22.81980187 109.72682391 -100.32193460 In 1.55245351 0.10410473 1.32704558 54.37438737 -115.64014352 131.99306178 In -0.20458635 1.66309296 1.49975075 -27.92712556 25.99696908 15.27271570