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=-0.9085393293593902 stress="-0.47009116676968593 0.03721216878512682 -0.035919310332658404 0.03721216878512682 -0.5721722470170584 0.0294670057059569 -0.035919310332658404 0.0294670057059569 -0.36317740911773794" free_energy=-0.9085393293593902 pbc="T T F"
O       2.70245745       0.16431082       0.03277713      -1.03597482      -0.92245885      -4.46369292 
O       1.31633532       1.37366136       0.21813893       0.39060674       1.73194174      -3.89445511 
O       1.49302631       0.19410236       1.33096497       1.18267481      -1.40245299       5.44872209 
O       2.88201197       1.43300593       1.22002482      -0.53730673       0.59297009       2.90942593