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=0.6861591473609858 stress="-0.6060747563218293 -0.22602311615856496 -0.03506814401924664 -0.22602311615856496 -0.5285501927286181 0.021089755598659176 -0.03506814401924664 0.021089755598659176 -0.41177983341968044" free_energy=0.6861591473609858 pbc="T F F" Li 0.30898017 0.01361598 0.06329927 -1.50343604 -4.70847580 -2.88832213 Li 1.52088773 1.27846858 0.09073906 0.76110547 4.80257039 -3.86483557 Li 1.77219963 0.13132919 1.75978669 -3.63703697 -7.20795320 3.69860922 Li -0.27407488 1.28504734 1.68365717 4.37936754 7.11385861 3.05454849