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=-2.1354706664616874 stress="-0.9781122821004087 -0.5742385071661718 0.1321701695474529 -0.5742385071661718 -2.009722827910644 -0.3129338654602053 0.1321701695474529 -0.3129338654602053 -1.2625169537566918" free_energy=-2.1354706664616874 pbc="F T F" Si 0.12263099 0.04530481 0.12593290 -10.08989432 -11.32867852 -18.62455712 C 1.34000708 1.18254356 0.23212867 15.30783596 6.63157826 -7.10194920 C 1.25294705 2.76067717 1.67871475 7.65669015 6.69550825 3.12367245 Si 0.19104769 1.46850990 1.45283623 -12.87463179 -1.99840799 22.60283387