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=34.51931607991563 stress="-1.8888504006773532 0.014550055804994478 -0.01590656652390179 0.014550055804994478 -1.0125849746912925 -0.002883542833443358 -0.01590656652390179 -0.002883542833443358 -1.9112559386241783" pbc="T F T" Na 0.03848316 0.19178619 0.17895518 2.01001421 -10.01091917 -2.96537784 Na 1.79140871 1.61455359 0.09583508 -2.84060249 11.21863880 -2.52193897 Na 1.64904689 0.10609294 1.40349439 -2.22979250 -10.48369216 2.08437817 Na -0.19401975 1.32157598 1.29208456 3.06038078 9.27597253 3.40293864