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=-17.622225911307194 stress="1.3826446584919168 -0.05989959317303964 -0.056834944963718805 -0.05989959317303964 0.9577415288678733 0.02041294644498756 -0.056834944963718805 0.02041294644498756 0.9839701490501417" pbc="T F F"
O      -0.20365767       0.29779494       0.26438373      -8.70568301      12.46471561      14.16013068 
O       1.79558487       1.54954039       0.23698464       6.33679386     -12.85367767       8.72572126 
O       1.68734388       0.29888928       1.34698057       8.97779322      10.60976080     -10.90901446 
O       0.03888080       1.25477488       1.47656121      -6.60890407     -10.22079874     -11.97683748