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=-11.488617875841934 stress="-0.414404141069566 0.17449080909878723 0.3048355104941953 0.17449080909878723 -0.2952415169968719 0.4594604459709601 0.3048355104941953 0.4594604459709601 -0.02101348483556689" free_energy=-11.488617875841934 pbc="F T T" H 0.10989136 -0.04412655 -0.07890074 -0.77698911 7.82769337 6.29455832 V 1.56729228 1.32607419 -0.08117910 3.20176970 4.90513192 -8.33622117 O 1.57022621 0.25131882 1.16426472 7.11085808 -6.35195212 2.92963953 C 0.51485459 1.21243667 1.07973801 -9.53563868 -6.38087317 -0.88797668