32 Lattice="76.98608779907227 0.0 0.0 0.0 76.98608779907227 0.0 0.0 0.0 76.98608779907227" Properties=species:S:1:pos:R:3:forces:R:3 energy=-18.61010105239424 stress="-1.029924511745948e-05 3.1802571002425874e-06 -1.6800173088340531e-06 3.1802571002425874e-06 -1.2711380097740101e-05 3.3788425328294344e-06 -1.6800173088340531e-06 3.3788425328294344e-06 -1.1625069175007622e-05" free_energy=-18.61010105239424 pbc="F F F" Na 38.37060507 38.28522201 38.55371013 0.12065123 0.10848436 0.08441738 Na 41.34014138 41.33216795 38.69796939 -0.27481870 -0.08342105 -0.53794287 Na 41.04177701 38.56571750 41.34433208 0.59290991 -0.38105005 -0.13941320 Na 38.71373563 41.11783747 41.45811328 -0.44236344 0.55735682 -0.39321957 Na 43.69170863 38.53755137 38.50946641 0.13475508 -0.19960549 -0.04139186 Na 46.78402370 41.07965182 38.48240614 -0.05506983 0.00758839 0.06132943 Na 46.66598144 38.47479630 41.39117318 0.19816722 -0.11497295 -0.23792829 Na 43.85120056 41.07688746 41.22633095 0.18715655 0.44785388 0.13136119 Na 38.73872181 44.16623300 38.31794973 -0.27850754 -0.30248333 0.07499689 Na 41.30960983 46.56472526 38.61597886 0.28830953 0.38205586 -0.10414463 Na 41.49038808 43.91152532 41.04375670 -0.07149613 0.22471518 0.70336381 Na 38.52376973 46.55755560 41.48483007 0.01397024 0.36611537 -0.37218784 Na 44.21576363 43.99840017 38.42512034 -0.32141660 -0.17915502 -0.24464255 Na 46.59579321 46.78221762 38.61510121 0.21335450 0.19115668 -0.16800261 Na 46.54077316 43.96314443 41.11817166 0.08840362 -0.01883324 0.30121535 Na 44.16466124 46.98739962 41.28513676 -0.51135510 -0.02191397 0.07798437 Na 38.59844990 38.40538199 43.82092729 -0.28862503 -0.26720450 0.41550129 Na 41.02091863 41.30109225 44.20064460 0.58325080 0.14379539 -0.28164967 Na 41.33773484 38.57952407 46.92121993 0.00082521 -0.16110994 -0.09171236 Na 38.44913113 41.20689694 46.62176225 -0.19796150 0.11249679 0.12121580 Na 44.15762408 38.82763573 43.87079755 -0.50769922 -0.28340242 0.30564310 Na 46.88109092 41.44880494 43.76498880 -0.02786605 0.00263846 0.21202173 Na 46.37352545 38.47686055 46.82715878 0.10094906 -0.01024901 -0.00478472 Na 43.86294312 41.21394163 46.80245190 0.03230159 0.29236017 -0.00521217 Na 38.39008585 44.07678327 43.77223615 0.06515490 -0.42370747 0.37936507 Na 41.19877256 46.81090728 44.17383982 0.17302042 0.09955771 -0.41947532 Na 41.21152278 44.07448256 46.82344348 0.09341633 -0.19435489 0.15953178 Na 38.56689561 46.60584750 46.65000037 -0.25689898 0.10148815 0.10781636 Na 43.80592994 44.18556889 44.12968864 0.02246226 -0.43130030 -0.44865047 Na 46.58184965 46.86808749 43.92749448 0.23846803 -0.04984712 0.01711808 Na 46.43793874 44.00791572 46.62946858 0.18419361 -0.04631029 0.15725604 Na 43.98361588 46.92817491 46.68772573 -0.09764200 0.13125783 0.18022047