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=13.8732014363 stress="-4.401174721719054 -0.21335923214193653 0.09893944092603782 -0.21335923214193653 -2.8922942370019635 -0.8588718692863813 0.09893944092603782 -0.8588718692863813 -3.061844672004738" pbc="F F F"
O      -0.06618674       0.13132919       0.25978669      -8.82085510      -6.53205272      -4.71067795 
O       1.22592512       1.28504734       0.18365717       6.94857361       4.50496623      -5.43215189 
O       1.70288723       0.08343331       1.29585403       6.12822452      -2.78779654       3.66420036 
O      -0.05190546       1.72094491       1.73171545      -4.25594303       4.81488303       6.47862948