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=1.8450437560846626 stress="-0.12093509056985788 0.002216639679926997 -0.0034438333218734284 0.002216639679926997 -0.1690788034838835 -0.02418630175099599 -0.0034438333218734284 -0.02418630175099599 -0.22206416084509512" free_energy=1.8450437560846626 pbc="T F F"
O        0.23573857       0.02724172       0.22083292       2.30505219      -1.92670571      -1.82387884
O        1.28984966       1.48735431       0.18107110      -2.07342831       1.58471818      -2.18633608
O        1.32825321       0.13102478       1.59995250      -2.39803750      -1.26258068       1.52697716
O        0.26120756       1.51193751       1.75226748       2.16641361       1.60456821       2.48323776