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=4.758121189377614 stress="-0.1861902286289967 0.02643167484228294 0.07839274635408942 0.02643167484228294 -0.23807140429059623 0.1461472572123626 0.07839274635408942 0.1461472572123626 -0.14375391573744425" free_energy=4.758121189377614 pbc="T T F"
O        0.19877714       0.10881314       0.13250256       2.77316672       4.76642550      -0.84003687
O        1.60031152       1.48308900       0.13572127      -1.31518304      -1.89746039      -1.72090710
O        1.55791531      -0.26612504       1.58457802      -1.51679991      -5.67958455       0.46979098
O        0.10917354       1.50693356       1.66501753       0.05881622       2.81061943       2.09115300