108 Lattice="10.001937870182559 0.0 0.0 0.0 10.001937870182559 0.0 0.0 0.0 10.001937870182559" Properties=species:S:1:pos:R:3:forces:R:3 energy=-207.94469940697238 stress="-0.0383275557090864 0.02357502105410189 -0.01002311258951198 0.02357502105410189 -0.022772499452517327 0.02874921384053718 -0.01002311258951198 0.02874921384053718 -0.04621446135177194" free_energy=-207.94469940697238 pbc="F F F" Si 0.05235203 0.01962781 0.02207386 -0.54263324 -3.47577068 -0.14888635 Si 1.70264591 1.65359558 0.03225882 0.81008823 -0.06920490 -3.62750629 C 1.69656248 0.02622723 1.65699697 4.07442383 -1.06027361 0.03491369 Si 0.01337457 1.69412193 1.66488562 -6.35935433 -4.84153338 3.60758943 Si 3.32097640 0.01950923 0.00113263 9.23627204 2.14451038 6.87791814 C 4.99681761 1.69617545 0.03844629 -6.43815531 -0.31168303 1.61132347 C 5.03424650 0.03548281 1.64534599 -3.63885774 -0.51799953 2.57387555 C 3.31153657 1.70274942 1.64365612 0.16144146 -0.16861935 0.78509711 C 6.69247811 0.00646319 0.02790964 0.00000000 0.00000000 0.00000000 C 8.33533439 1.63797949 0.05667273 0.00000000 0.00000000 0.00000000 C 8.31319816 0.02532806 1.66592875 -1.82064826 2.71353881 4.71149156 C 6.66473371 1.68074623 1.67288499 -1.71962448 1.24201805 2.42578187 Si 0.00157732 3.30339972 0.02628160 -0.90053100 3.39807059 -4.25387682 C 1.67592857 5.02017823 0.04241525 2.29243137 -4.06939586 1.75729707 C 1.64077225 3.34744368 1.64416891 4.53104477 1.46679147 -1.54958829 Si 0.03229826 5.03849465 1.67896563 -5.82972114 0.71450525 -7.93764781 Si 3.31859000 3.31567834 0.02760985 -1.35528886 8.98287493 -0.40244001 C 4.99485949 4.94438116 0.02701892 0.00603704 -1.14497043 1.15681548 Si 4.96953031 3.35434032 1.67602395 3.88552937 -6.56181874 -5.30899686 C 3.37211102 4.99722368 1.66214334 0.40144979 -0.78394153 -0.52703162 C 6.68714346 3.34086022 0.01113286 0.96017847 3.15594736 2.13294445 Si 8.33265377 5.01664627 0.03028779 0.65085975 -6.96986798 -1.47434702 C 8.33304778 3.34344855 1.70100048 0.86957453 0.83969296 1.11025735 Si 6.69576010 4.98236180 1.68352306 -4.20070408 -1.65625212 -4.07108189 C 0.03520111 6.61672890 0.01112497 0.93702383 0.36016545 2.17576413 Si 1.66065836 8.35491017 0.03985324 5.78749957 -2.03858822 -1.04885062 Si 1.66936196 6.67079041 1.69549757 8.43090399 -1.20439639 -8.52164542 Si 0.03199713 8.36163066 1.66188924 -2.29895449 2.84995229 1.57734103 C 3.32640836 6.68536201 0.04569975 -4.51474921 2.59110173 1.75916346 C 5.02635772 8.32903162 0.03852678 4.27040334 -4.43220336 -0.22712961 C 5.03637426 6.64894717 1.63954205 0.37192176 -0.13900588 2.46903129 C 3.34453728 8.32382630 1.67343150 -3.25130549 -2.10677613 -1.10594499 Si 6.65316181 6.68350292 0.02116277 -12.81470067 3.91133460 -2.70259972 Si 8.29525763 8.33571797 0.02629519 0.09621080 3.41359626 -0.40930618 Si 8.32486468 6.72366846 1.71137807 7.97957256 -0.71450053 -1.29206124 C 6.64933054 8.35081207 1.66282370 1.73387012 1.51699049 0.30880662 C 0.03763819 0.00231422 3.33613685 1.86223061 4.23265027 -2.11032103 Si 1.65694049 1.69168966 3.36979510 -4.43402698 -10.10630004 -1.97641737 C 1.64454896 0.01175680 4.96817482 1.56216995 1.77127148 -1.29180834 C 0.01987349 1.66456828 5.02907018 -0.38154498 1.78287689 0.51378128 Si 3.37630853 0.01813699 3.33785624 -1.46426139 -2.30178863 -10.03952081 C 4.95193625 1.66249114 3.32498557 -0.61706168 0.90198368 -4.69957834 Si 4.98007393 0.00865381 4.97208421 -2.72735897 -7.22680077 5.22459001 Si 3.31703395 1.65775080 5.03086288 1.58249782 -5.43873132 3.70175559 Si 6.63882290 0.02195684 3.35372472 -2.28080557 -3.10117590 -12.77991648 Si 8.33313628 1.67673864 3.31673310 6.02201999 1.45679002 -7.75664619 Si 8.36045186 0.00848433 5.02873008 4.48216253 -1.81527765 1.85808274 Si 6.66960718 1.63808858 4.99223761 3.04759430 6.97821092 7.25449512 Si 0.00399209 3.32643277 3.34936370 -8.88965917 0.39904044 4.75899194 Si 1.61948051 5.01372972 3.31124161 2.77847782 -3.94724079 -0.61303968 Si 1.68306650 3.30549930 5.01886978 -1.62401296 4.58812879 0.70973076 C 0.02042561 4.99840695 5.02122668 -1.08266540 -1.33774649 1.20227060 Si 3.31603841 3.31844994 3.34240096 0.73036721 -0.42675907 -6.58862059 C 5.00390113 4.99643291 3.35751803 0.46839333 3.07823118 0.03732883 Si 5.00161489 3.32566880 5.02210315 5.23583621 0.50738031 0.04626834 Si 3.36583753 5.00852558 4.98093770 2.66024527 3.78928678 0.93626088 Si 6.66280492 3.34632474 3.35632641 -0.49008165 0.28304900 0.72263133 Si 8.33165918 5.01121468 3.33150878 6.51379257 -2.11218851 7.76262174 C 8.35170494 3.29061057 4.99192626 -0.25727463 0.26621123 -3.90836319 C 6.65592391 5.02754007 5.00553944 -2.03004006 0.84012791 -0.89254748 Si 0.01004568 6.64406262 3.34787105 -9.57211645 0.28394529 2.83073588 C 1.69181846 8.31942141 3.35364162 0.18100309 2.81887909 0.91134533 Si 1.68501653 6.65508493 4.97450532 -4.83937604 -5.43657747 9.12055203 Si 0.01534514 8.34880886 5.06484863 -2.88064206 1.26499079 -0.70148356 Si 3.31716137 6.66682166 3.35878226 13.32539590 3.87222200 -11.34105858 C 5.01834947 8.32076087 3.33588592 -0.45300268 -2.93239968 4.33646438 C 4.97930373 6.68525499 5.04213491 0.95999988 0.98320504 0.06919013 Si 3.30267548 8.32518722 4.99576364 9.06620166 3.71136184 0.06493133 Si 6.64329255 6.68087566 3.35068339 -12.33400556 -2.63271299 2.98458157 Si 8.30231696 8.34073446 3.35493081 2.65494842 2.72284827 0.35720540 C 8.35092281 6.71527807 4.99922129 1.71729483 1.53728359 -0.70874703 Si 6.64919749 8.35540554 4.97125089 -11.41411643 0.61873577 6.61722349 C 0.01624748 0.01929228 6.68179725 2.44060011 2.16662379 3.73846369 Si 1.65241537 1.69836289 6.68372603 -0.46555430 -7.27558424 -1.11079109 Si 1.68012853 0.00869746 8.32887416 5.07281610 -1.31878863 -2.34458661 Si 0.02398376 1.70524107 8.31546318 -2.28580330 -0.05669435 3.19118863 C 3.28603070 0.00746658 6.66148520 -0.80162698 0.69340045 -0.07390003 C 5.00258521 1.68119534 6.67508391 0.94605440 0.81868854 2.82771614 C 5.02344795 0.02209890 8.36431700 4.77787291 -0.16280231 -4.97339021 C 3.31175765 1.65156156 8.29651469 -0.59624690 0.11428296 -0.38868448 Si 6.62888744 0.01688915 6.65468093 -0.70225859 3.07792648 19.81972231 C 8.28815647 1.64870636 6.62424930 -0.53877059 -1.93985364 -1.72956713 C 8.33594005 0.04451398 8.32990126 -4.63375248 -0.18095668 -4.47282655 C 6.65230586 1.69003726 8.31849509 -5.02375597 0.79345587 -3.79181425 Si 0.00215440 3.32286402 6.62495942 -4.09677863 12.48101742 1.53771856 C 1.65964413 5.00641512 6.68273766 -1.40842650 1.30246467 1.14366734 C 1.66984120 3.29852838 8.35047575 1.12021552 1.12565583 0.68325317 C 0.06126159 5.00565341 8.31125641 -0.26943854 -4.82828370 -4.88428956 Si 3.37209433 3.32442577 6.65713051 -2.09213537 -3.34206595 5.07443910 Si 4.98159538 4.96788206 6.67492724 15.29673869 15.86222974 0.76379594 Si 4.97506440 3.35405115 8.34328531 10.63350781 -10.35045521 2.45649179 Si 3.32058940 4.98715919 8.32504012 -11.27572815 7.40294105 1.05910404 C 6.66311738 3.32130435 6.67138996 -2.45181196 -0.98806883 -0.71096381 C 8.35582448 5.02713481 6.64879535 0.13852637 5.06692343 5.30013962 C 8.30174790 3.29308777 8.28643372 0.00000000 0.00000000 0.00000000 C 6.68451008 5.02985492 8.35370462 0.86471512 2.62993572 -1.75874227 C 0.00937259 6.67534520 6.65274840 -0.62485125 3.80391276 0.44340064 Si 1.67200869 8.31591012 6.67283052 0.42237547 3.32024146 2.23911431 C 1.63899870 6.66228497 8.33571944 3.32278001 1.15114839 0.49935748 Si 0.01228716 8.32176039 8.32009165 0.43812346 -5.44287104 -0.39986559 C 3.34209766 6.68386644 6.68917510 1.19639164 -1.24459283 2.29798967 C 4.97811408 8.32938720 6.67723756 -3.54615589 0.47004968 -2.72676458 C 5.00294773 6.68774540 8.34042706 -6.47516434 0.52363785 -1.81006014 Si 3.32068159 8.32359724 8.32669335 9.20972809 -7.36265578 -3.09047624 C 6.67454752 6.68933411 6.69483421 -2.09623168 -2.06542605 -0.00016208 Si 8.34867938 8.32544129 6.65722275 -1.08959023 -1.15638581 -0.64545646 Si 8.34522119 6.69562002 8.34159432 -10.14462611 -9.30795420 -5.08264462 C 6.63995761 8.31755085 8.30607590 5.85817501 -2.68839710 -2.16001770