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=206.5733698226746 stress="-14.155185303508047 0.5639861363390171 4.130443020044877 0.5639861363390171 -13.078811822704054 0.027293540208687815 4.130443020044877 0.027293540208687815 -9.244365294636932" free_energy=206.5733698226746 pbc="T T F"
O       2.78802619       0.26125400       0.18584377     124.53512510     -20.33693900    -137.09374206 
O       1.68362810       1.65356579       0.14685009     -31.65950316      25.53312372     -61.17897917 
O       1.76959405       0.17626233       1.35402479     -78.62387634     -26.36429446     146.11542614 
O       0.40174959       1.49207130       1.65300231     -14.25174561      21.16810973      52.15729509