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=20.00907100177821 stress="-2.9813316799718197 0.13109922334108534 -0.0783182529077924 0.13109922334108534 -3.2067648798611934 0.02235815204729955 -0.0783182529077924 0.02235815204729955 -3.091273657363061" free_energy=20.00907100177821 pbc="T T T" Ga 2.85540510 0.11115480 0.11044915 5.00956447 -5.26827499 -0.61146083 Ga 1.70960170 1.31143450 2.71512922 -8.57041823 2.89837022 4.00439759 Ga 1.28829595 2.79404596 1.64041416 -2.30139171 1.89927352 -3.57763272 Ga 2.77812781 1.51878885 1.32834452 5.86224547 0.47063125 0.18469596