16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.7570258087999 stress="5.031405485698489 -8.74611370312088 -0.6275051334816801 -8.74611370312088 1.7047890516775919 -11.72232876681965 -0.6275051334816801 -11.72232876681965 2.089366034059214" pbc="F F F" W -0.05339222 -0.16543235 0.17589409 -0.10267917 0.30244107 -0.07271279 W 1.55293465 1.39971974 1.37366136 0.08877819 5.66108394 1.51773994 W 2.84068451 -0.21780693 0.21813893 0.49514173 -2.17944814 -1.71925758 W 4.26716069 1.69410236 1.33096497 2.50481194 -4.25041338 1.16046414 W -0.11798803 2.93300593 -0.27997518 2.10592441 -0.89771501 2.25714071 W 1.27696427 4.69373086 1.34383310 2.76194888 -1.25379410 -0.28825675 W 3.22586561 3.29391194 -0.27385471 -4.97686693 -1.11049157 -1.84986623 W 4.52103145 4.27761356 1.43433282 2.47905712 4.77817510 1.99310018 W -0.10637159 0.23573857 3.02724172 -6.48110017 -4.90600361 -5.97074197 W 1.27538150 1.20296332 4.34887301 7.77838619 5.45890058 5.22532241 W 3.22083292 -0.21015034 2.98735431 -1.70171799 1.47121757 -0.79916804 W 4.42299150 1.40698366 4.68107110 -1.08071882 1.86073011 -1.45434411 W -0.03558597 3.13102478 2.86424510 0.59078936 -1.61714398 0.59581386 W 1.89088973 4.73174279 4.70687691 -0.39737403 -0.30982555 -1.02753327 W 2.96431997 3.04396501 3.07236142 -2.20768399 -1.14851792 1.47891744 W 4.70379337 4.73854596 4.34250117 -1.85669673 -1.85919511 -1.04661795