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=1.777076612889892 stress="-0.11825861740046723 0.01831458450602471 -0.011867712718425039 0.01831458450602471 -0.12731682317973386 0.045553607679726105 -0.011867712718425039 0.045553607679726105 -0.07581178719735895" free_energy=1.777076612889892 pbc="F F T"
O        0.24849743       0.25911890       0.19019325      -0.34796477      -0.38163875       2.41065818
O        1.69877714       1.60881314       0.13250256       1.43261178       1.49712264       1.17843399
O        1.60031152       0.05442580       1.35431870       0.67798681      -1.90602144      -1.22450267
O        0.13572127       1.55791531       1.23387496      -1.76263381       0.79053755      -2.36458950