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=-14.877526957206728 stress="-0.37844700036041196 0.3184839081706456 0.03438730494003378 0.3184839081706456 -0.9361807075739409 -0.08191677723184501 0.03438730494003378 -0.08191677723184501 -0.5250312570802836" free_energy=-14.877526957206728 pbc="F T F" B 0.13661615 2.90480033 0.11041876 -5.82211752 -4.01474815 -2.67869659 B 1.26735611 1.33533445 0.08611608 6.09798639 3.47465506 -9.04965449 B 1.53369179 0.02598936 1.22329650 2.72689420 -10.21549879 5.99444918 B 0.29874826 1.27290972 1.38090187 -3.00276306 10.75559188 5.73390190