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=114.73913753970805 stress="-8.503061942747244 -0.30585783235130304 0.5150186719873914 -0.30585783235130304 -8.09657649204778 -0.035389303561970654 0.5150186719873914 -0.035389303561970654 -4.396478005383161" free_energy=114.73913753970805 pbc="T T F" Na 2.89524162 0.29740925 0.03687099 5.93157938 -4.44323824 -47.43386772 Na 1.55225724 1.50640802 0.26845615 1.55860254 0.82716709 -46.13065705 Na 1.44199471 2.91849172 1.32508788 18.60151584 25.62154567 43.51855030 Na 0.25593045 1.94148435 1.50205895 -26.09169775 -22.00547452 50.04597447