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=3.8508590584168245 stress="-0.7401270448795125 -0.04751280448436341 0.004231460478235486 -0.04751280448436341 -0.6407800013280381 0.17989540487231298 0.004231460478235486 0.17989540487231298 -0.3248944746995838" free_energy=3.8508590584168245 pbc="T T F"
O       0.33563275       0.19989723       0.12961200      -1.48379403       0.60734301      -2.52401124 
O       1.22263956       1.65720406       0.50773809       2.48188992       5.83096145      -5.96131005 
O       1.69485422       2.81034357       1.66132465       0.07472073      -0.12953219       4.04425019 
O       2.82698322       1.20220318       1.21755886      -1.07281661      -6.30877227       4.44107110