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=2.4459547754380053 stress="-0.12170794152393237 -0.009940199661923626 -0.09860693508792984 -0.009940199661923626 0.09211298215886725 0.029236275125139526 -0.09860693508792984 0.029236275125139526 0.009814703853631103" free_energy=2.4459547754380053 pbc="F F T"
O       0.17089611       0.26235339       2.84838096      -1.26147888       1.22468255      -0.51509976 
O       1.71005355       1.63745972       2.94968690       1.05796479      -0.45064212       0.61732646 
O       1.79594673       0.15710459       1.49042854       1.05705790       0.65377468       1.10593375 
O       0.24122900       1.52201293       1.31634348      -0.85354380      -1.42781512      -1.20816045