16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1.2340975775200143 stress="-0.0020173611589736494 -8.422568847413964e-05 -8.25698169320382e-05 -8.422568847413964e-05 -0.0018720833162421875 -8.414800337391888e-05 -8.25698169320382e-05 -8.414800337391888e-05 -0.0019672363289852573" pbc="F F F" Sm 20.82702941 21.07034430 21.04852473 -4.81411791 -5.44125887 -6.54589466 Sm 22.55473499 22.26216559 22.63661615 3.22700827 4.45913684 -7.54527185 Sm 23.77721269 20.87719504 20.79869006 0.95040577 -6.89572029 -6.84792967 Sm 25.61041876 22.08966455 22.24582604 8.34906984 0.16498706 1.30538133 Sm 20.74148635 23.80898028 21.03369179 -6.08540291 2.92921606 -7.45968986 Sm 22.52598936 25.22329650 22.46375436 2.86531843 13.67842274 -5.26040742 Sm 23.90583543 23.75559716 20.70178472 1.79974778 2.44682952 -8.66408997 Sm 25.79874826 25.27290972 22.31948260 3.23527233 2.46724220 -0.83954999 Sm 20.86136659 21.05835534 23.74645637 -11.24591970 -8.63462926 5.56283138 Sm 22.48193431 22.17207285 25.70070203 -3.05772102 0.65476957 12.47304158 Sm 23.70342959 20.90085166 23.99793547 9.30263403 -14.07173315 4.21891580 Sm 25.78187239 22.51001192 25.48453339 4.44833338 -2.19239321 2.90849217 Sm 21.10170120 23.87793365 23.71904386 -14.24473660 2.82712173 9.17475254 Sm 22.50082602 25.74624097 25.64302402 -5.18414698 5.79853912 5.53764912 Sm 23.85498893 24.11042859 24.36435907 2.64570279 -4.78519117 -2.74533298 Sm 25.35512851 25.55280714 25.41333883 7.80855251 6.59466111 4.72710248