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=1.3894527150158704 stress="0.00762681408986659 -0.14873657369559676 -0.1080324765921668 -0.14873657369559676 -0.11901070868575522 0.10603175931169262 -0.1080324765921668 0.10603175931169262 -0.17540421301761228" free_energy=1.3894527150158704 pbc="F T F"
O        0.04737131       0.15501883       0.24404962      -1.38466294      -0.17164116      -2.10795751
O        1.36810690       1.62937675       0.09119645      -0.86928082       2.60741041      -0.84592916
O        1.34171359       0.21456242       1.77913633       0.54645000       0.78427343       3.13610284
O        0.18492541       1.33178173       1.38323780       1.70749375      -3.22004268      -0.18221617