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=21.420036629077085 stress="-1.4592655087521427 0.010174048356283475 -0.029497636672782802 0.010174048356283475 -1.5065080995838214 -0.016065596574579684 -0.029497636672782802 -0.016065596574579684 -1.5325602914117178" free_energy=21.420036629077085 pbc="T T T" Na -0.14459490 0.11115480 0.11044915 1.77231701 -2.02501695 -0.32793078 Na 1.70960170 1.31143450 -0.16166483 -2.60440070 2.19386177 0.46084668 Na 1.28829595 0.03769167 1.64041416 -0.91462574 -1.47532293 -0.76997681 Na -0.22187219 1.51878885 1.32834452 1.74670943 1.30647811 0.63706091