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=223.19401247188512 stress="-17.463305302586942 -0.22639986327636638 -0.25635017064276167 -0.22639986327636638 -17.524769803792815 0.21357352559136275 -0.25635017064276167 0.21357352559136275 -9.361904221570606" free_energy=223.19401247188512 pbc="T T F" Te 2.70245745 0.16431082 0.03277713 39.85749012 -42.93598166 -106.98561739 Te 1.39971974 1.37366136 0.21813893 -59.31174114 50.22206771 -112.97269298 Te 1.49302631 0.19410236 1.33096497 -46.70471868 -57.91725814 113.27962557 Te 2.60815726 1.43300593 1.22002482 66.15896970 50.63117209 106.67868479