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=-1.7406071367584115 stress="-0.7548847560777826 -0.09673156351698159 0.09059215678816702 -0.09673156351698159 -1.0504762116313997 -0.07464984101629807 0.09059215678816702 -0.07464984101629807 -0.14981699724215738" free_energy=-1.7406071367584115 pbc="F T F"
O        0.27544140      -0.24837367       0.28148913      -7.34716659       0.14218249      -0.26173535
O        1.55210001       1.46864501       0.26147517       7.18912590      -3.72509420      -4.43234344
O        1.50736779       0.00505582       1.00415382       8.44314523       5.80564816       2.75986419
O        0.17858111       1.58352372       1.29579963      -8.28510454      -2.22273645       1.93421460