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=223.19381852787464 stress="-17.463308682405085 -0.22640246526752886 -0.2563415310253152 -0.22640246526752886 -17.524787914028828 0.21358502841708396 -0.2563415310253152 0.21358502841708396 -9.361903675512762" free_energy=223.19381852787464 pbc="T T F" Te 2.70245745 0.16431082 0.03277713 39.85709970 -42.93566907 -106.98556247 Te 1.39971974 1.37366136 0.21813893 -59.31101727 50.22199727 -112.97270811 Te 1.49302631 0.19410236 1.33096497 -46.70446229 -57.91734858 113.27994374 Te 2.60815726 1.43300593 1.22002482 66.15837986 50.63102039 106.67832684