32 Lattice="7.652631304906052 0.0 0.0 0.0 7.652631304906052 0.0 0.0 0.0 7.652631304906052" Properties=species:S:1:pos:R:3:forces:R:3 energy=-205.47683698195215 stress="-0.21670756079709916 0.03368298899617674 0.021203985657668296 0.03368298899617674 -0.2353624450345475 -0.011719819472767826 0.021203985657668296 -0.011719819472767826 -0.23886512676880697" free_energy=-205.47683698195215 pbc="F F F" W 0.00407426 0.05022090 0.00075826 -1.94752443 -1.87683560 -2.55556372 W 1.93478703 1.90984947 0.03802851 -0.08043449 5.18452444 -6.34893137 W 1.88584187 0.03427015 1.89733180 4.79719617 -5.80311476 4.70774142 W 0.03250287 1.89859012 1.92896132 -6.68104878 2.58180051 -1.53890120 W 3.77531250 0.00139380 0.00870291 3.13568916 -2.20803322 -1.73955231 W 5.74556527 1.88884536 0.02595283 0.00747788 2.93970567 -2.85308486 W 5.72085211 0.01393336 1.87837405 0.86911191 -3.17494298 3.54552915 W 3.83724010 1.92595545 1.93420386 -3.90218147 -2.80218845 -1.02607566 W 0.01699556 3.81208977 0.03179464 -1.40757894 -1.21261439 -2.62297135 W 1.92817140 5.72735299 0.02707031 -2.04441554 0.37262187 -2.86023392 W 1.90101893 3.79744574 1.93692340 7.75316079 2.55902851 -0.67065871 W 0.02687819 5.69761548 1.93504624 -3.13410743 4.64365170 -0.82083892 W 3.87266353 3.86442246 0.00271173 -4.30458689 -5.41326552 -4.74481880 W 5.76703537 5.72625623 0.02747103 1.70598613 1.54339749 0.57274358 W 5.70139046 3.80371367 1.93340766 7.82339640 3.99624136 -2.22171311 W 3.80435065 5.74068505 1.88493299 1.80128720 2.72588710 5.59922147 W 0.01327924 0.03220713 3.80359209 -2.27215762 -4.72664848 2.00941839 W 1.91730021 1.92531450 3.85606629 4.28211603 -1.61514646 -6.12762693 W 1.90918342 0.03782527 5.74748950 1.26329488 -4.02072334 2.33936559 W 0.01125618 1.89933472 5.71523283 -4.50754157 3.26720631 3.91016593 W 3.81514594 0.03205057 3.85530701 1.21702447 -4.72220815 -3.98534187 W 5.73362171 1.94602185 3.83668961 5.70045100 -5.68101259 -1.45768007 W 5.73681114 0.02296714 5.75388217 1.49171138 -1.18109466 -0.45884844 W 3.85119767 1.90155147 5.71831351 -3.49898462 4.10133841 6.06489977 W 0.02318084 3.78817703 3.79643985 -5.62764274 2.60188236 5.65490020 W 1.89188602 5.74293673 3.85854250 4.25321965 0.79796821 -2.15648907 W 1.93073901 3.79235365 5.72651200 0.46600812 2.74811181 3.34703704 W 0.03140765 5.73151536 5.73982940 -1.61467960 -0.87376102 1.60528129 W 3.85506355 3.82903236 3.80979003 -5.73509780 3.23700351 3.72399760 W 5.77056280 5.73688356 3.81980049 -0.29454896 -0.01336444 -0.28538376 W 5.74273336 3.80354831 5.74923491 0.77888019 2.44809366 1.72641570 W 3.81679347 5.74387206 5.76055567 -0.29348051 -0.42350886 -0.33200307