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=4.394342018996005 stress="-0.9441045183985095 0.04617120878872358 -0.034606462019476196 0.04617120878872358 -1.5694028450148494 -0.08456144406346112 -0.034606462019476196 -0.08456144406346112 -0.9588472163849017" free_energy=4.394342018996005 pbc="F T F" Ga 0.05473499 2.91561068 0.13661615 -11.90825325 4.15886992 -10.13819006 Ga 1.40480033 1.67594331 0.11041876 8.70806720 -7.09728609 -10.88520771 Ga 1.26735611 2.83533445 1.24148635 11.54205629 6.97823167 12.67344379 Ga 0.08611608 1.53369179 1.52598936 -8.34187024 -4.03981550 8.34995398