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=6.35725106050328 stress="-15.470801231488885 -2.1012495461800595 0.8716932438826337 -2.1012495461800595 -9.873476892883694 0.7195139323098827 0.8716932438826337 0.7195139323098827 -15.63315250333261" pbc="F F F" Na 0.27219963 -0.06618674 0.13132919 -5.84666082 -5.12475852 -3.76648363 Na 1.75978669 1.22592512 -0.21495266 4.92840455 4.76061979 -5.41770687 Na 1.68365717 0.20288723 1.58343331 4.54325853 -2.54641541 6.12482620 Na -0.20414597 1.44809454 1.72094491 -3.62500226 2.91055414 3.05936430