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=3.92363688006754 stress="-0.5244973970966106 0.054040451037958404 0.05518565127563216 0.054040451037958404 -0.04737082913339732 0.3362522810917958 0.05518565127563216 0.3362522810917958 -0.5251655570038838" free_energy=3.92363688006754 pbc="T F T"
O       0.27143892       0.14189940       0.24759167      -0.46323327      -0.91258928       3.70809373 
O       1.35813690       1.25447653       2.74663523       1.83632334      -0.99236860      -7.61345857 
O       1.48702489       0.18843096       1.67061300       1.31262636       0.11269093       4.52243709 
O       0.29169807       1.46863002       1.23378487      -2.68571643       1.79226695      -0.61707225