108 Lattice="15.560413781285403 0.0 0.0 0.0 15.560413781285403 0.0 0.0 0.0 15.560413781285403" Properties=species:S:1:pos:R:3:forces:R:3 energy=-101.65868378852453 stress="-0.22659401809954743 -0.08899056984925488 0.042149838054753586 -0.08899056984925488 -0.3177441750088841 -0.012630959030417444 0.042149838054753586 -0.012630959030417444 -0.3255763464687" pbc="F F F" Na -0.00809683 0.03839275 -0.04567849 0.07323071 0.06386758 0.06614258 Na 2.63336899 2.61959789 0.00435122 -0.00572815 0.00869825 -0.03749539 Na 2.63699991 0.01031683 2.59900179 -0.04604936 -0.03755395 0.01507927 Na -0.04173349 2.59472418 2.56266979 -0.02182041 0.01672272 0.02806642 Na 5.14674983 0.00909729 0.07118058 0.02013829 0.00553691 -0.01248752 Na 7.79976824 2.57996017 0.03392553 -0.01550739 0.02716590 -0.06792745 Na 7.79896903 -0.01864269 2.58328195 -0.00202438 -0.07138621 0.03370067 Na 5.23459240 2.59730086 2.69156299 -0.03513829 0.02598377 -0.04079349 Na 10.37561336 -0.04018124 0.02150462 -0.01153573 0.02410771 0.02369773 Na 12.99824255 2.55184268 -0.00714611 -0.03689657 0.03417267 0.02917992 Na 12.99058968 0.01381058 2.63877555 -0.02980765 0.02022338 0.01092265 Na 10.34207889 2.63612740 2.56712268 0.01288854 -0.01370234 0.02482593 Na -0.04755886 5.16257451 -0.03084451 0.03128833 -0.00163743 0.01822707 Na 2.59716320 7.77751580 -0.04821792 0.00669055 -0.02009293 -0.03704889 Na 2.65737188 5.17671691 2.58506880 -0.01366144 -0.00393957 0.01683290 Na -0.00394969 7.74896541 2.58135879 -0.03181566 0.00623025 0.01029981 Na 5.18326880 5.17426281 -0.03677747 0.02569579 0.01115316 -0.04466333 Na 7.79551166 7.82760098 -0.00716560 -0.02026524 -0.02105376 -0.06024877 Na 7.74498136 5.20399189 2.59793021 -0.01530235 0.01619694 0.02343338 Na 5.20602560 7.81789748 2.59677426 0.00090501 -0.03077140 0.01964721 Na 10.40214664 5.23184463 0.03611613 -0.02364805 -0.02436961 -0.07658437 Na 13.00808849 7.79265826 0.08350784 -0.00191929 0.00881075 -0.00298257 Na 13.00883089 5.15727409 2.60602909 0.05954789 -0.01510991 0.00810375 Na 10.36224207 7.72915590 2.58820824 -0.02461361 0.03728513 0.02544368 Na 0.02983540 10.39180101 0.00434724 0.01524399 -0.02816769 0.02313361 Na 2.60618465 12.98996081 -0.00402144 0.01032328 -0.00984683 0.00887607 Na 2.64080330 10.38191544 2.54791801 -0.01762700 -0.03959713 0.03817318 Na -0.02937357 12.99114494 2.60758951 0.03073249 -0.02017366 0.00953271 Na 5.15355565 10.35882530 -0.04764889 0.00895759 -0.01563885 -0.06383137 Na 7.75086087 12.91606772 0.01822000 0.01160115 0.00809271 -0.00383544 Na 7.73904635 10.38753872 2.60472119 0.02601107 -0.01808304 0.03365943 Na 5.13798849 12.97728156 2.55435175 0.02940076 0.05734177 0.04537661 Na 10.35143357 10.36377946 0.02266649 0.00498703 -0.00643327 -0.04371630 Na 12.92215798 13.01513054 -0.00822109 -0.06178007 -0.06177648 0.06272674 Na 12.93152256 10.41936212 2.59258034 0.06181327 -0.02933337 0.01596913 Na 10.36648800 13.00092768 2.62735107 -0.02916816 0.04065199 0.00639974 Na -0.03455474 -0.00300396 5.19257055 0.02254901 0.00758445 -0.00741520 Na 2.55200142 2.57679240 5.21211447 0.04465549 0.01879003 -0.03059501 Na 2.63651880 0.00503927 7.78909443 -0.01624712 -0.04551678 0.01312140 Na -0.02885425 2.62069243 7.73699628 -0.07106780 -0.01290886 0.04450596 Na 5.13776359 -0.03036230 5.17181296 0.01907278 -0.05434357 0.01833121 Na 7.75366844 2.55060103 5.14835606 0.03071438 0.05197623 0.04858456 Na 7.75185221 0.00925098 7.72193066 0.00776429 -0.05708216 0.02124314 Na 5.17918823 2.66681687 7.82532976 0.00456196 -0.02976102 -0.03633693 Na 10.38067203 0.02333472 5.19774114 -0.01505907 -0.06464804 -0.01570462 Na 12.94686656 2.58993358 5.17528806 0.06381971 0.02687697 0.00887680 Na 12.97669274 0.01569857 7.82756094 0.01767537 -0.01674649 -0.02126899 Na 10.41716110 2.54852518 7.79982596 -0.07853440 0.06329793 -0.02772972 Na 0.01643202 5.17913250 5.19045980 -0.06906128 0.01134919 -0.02982908 Na 2.62907727 7.74822580 5.16037468 0.01154824 0.03634782 0.03076092 Na 2.56639010 5.13499367 7.75953532 0.05580107 0.05408684 0.02630650 Na 0.04523123 7.73546440 7.83087638 -0.06215843 0.04271046 -0.03041259 Na 5.17951342 5.17021165 5.23375785 0.01884782 0.03703364 -0.01123477 Na 7.82296337 7.82173886 5.20418965 -0.04014018 -0.03572083 -0.00063299 Na 7.76319964 5.15363299 7.77250212 0.03568611 0.01284870 -0.03050461 Na 5.21724178 7.80492299 7.82265536 -0.02702570 -0.02044200 -0.02295624 Na 10.34987251 5.17290270 5.14093676 -0.03928886 -0.01824997 0.04515271 Na 12.92423089 7.72509563 5.16863510 0.08371684 0.01673120 0.00541019 Na 12.93646315 5.16775067 7.79004524 0.06250432 0.01021653 -0.01975310 Na 10.36500979 7.77887832 7.78210161 -0.02372983 -0.01589441 -0.02803475 Na 0.02677219 10.39305563 5.14203054 -0.04983796 -0.05807708 0.01314848 Na 2.59007011 12.93361367 5.14794660 0.02280780 0.07235717 0.01110525 Na 2.56855909 10.41726579 7.81768898 0.03658160 -0.08498540 -0.03581967 Na 0.02377049 12.94358448 7.80376709 -0.01397434 0.01083365 -0.01121764 Na 5.19692340 10.37932782 5.21694700 -0.01488827 -0.04047370 -0.01047814 Na 7.77944117 12.98482710 5.20327152 0.02057907 0.04225201 -0.01728986 Na 7.80005016 10.37502975 7.79385554 -0.01144577 -0.02095742 -0.00121874 Na 5.21526139 12.94519332 7.72978714 -0.01438111 0.07490179 0.03663511 Na 10.42229607 10.31589309 5.17494840 -0.04439081 0.04242030 0.01302078 Na 13.00500286 13.00749092 5.14653400 -0.02402762 -0.01612079 0.01817677 Na 13.01546779 10.38438051 7.79028752 0.04394302 -0.03272133 -0.02858683 Na 10.39476958 12.95521413 7.82842520 -0.02661507 0.04940634 -0.03979797 Na -0.04194185 -0.04854021 10.38872578 0.03988966 0.04334182 -0.04706897 Na 2.54425418 2.64129365 10.33832265 0.02422723 -0.02354980 0.01217811 Na 2.55461190 -0.04802256 12.98994007 0.04001210 0.04638782 -0.05007974 Na 0.00191842 2.60309361 12.93892980 0.01489118 0.01479817 -0.01028539 Na 5.21820147 0.04570466 10.34883733 -0.01668706 -0.05441679 0.01544575 Na 7.81595066 2.58587837 10.34614338 0.00832353 0.03107715 0.00706756 Na 7.85538672 0.03225087 12.97321032 -0.02233543 0.00295536 -0.00894998 Na 5.15405529 2.62093005 12.95465714 0.01548177 -0.01546134 0.04564326 Na 10.42089104 -0.01518869 10.37689373 -0.05247449 -0.05302790 -0.01887600 Na 12.95612829 2.61271563 10.32537764 0.05098830 0.01864354 0.03472728 Na 12.96960571 -0.01878497 12.92242766 -0.05525629 0.06928496 -0.05412546 Na 10.35653253 2.60804955 13.01017334 0.01196714 0.02807533 0.02091345 Na -0.03426705 5.21835173 10.40758560 -0.05324369 -0.01448081 -0.02000648 Na 2.60746599 7.74410648 10.38873548 0.01614702 -0.00452894 -0.02681685 Na 2.60970099 5.16339974 13.00480343 -0.00495413 0.01375909 0.04810547 Na -0.01328252 7.78917610 12.99568108 0.02841684 0.01047216 -0.00829909 Na 5.22411974 5.19503961 10.40514294 -0.02241749 -0.00601601 -0.04242540 Na 7.79929096 7.72277784 10.37421950 -0.03266434 0.04414849 -0.01485625 Na 7.78458545 5.21026790 13.00961742 0.00343470 -0.02291849 0.05825701 Na 5.16948681 7.75384713 12.98436094 0.02216207 0.01922960 0.05931393 Na 10.33628939 5.23452733 10.35650826 -0.00346186 -0.05031488 0.00430043 Na 12.91940400 7.77230358 10.34741073 0.07809451 0.00850153 0.00282983 Na 12.99973780 5.14355354 12.94273336 -0.01952699 0.00519301 -0.01558083 Na 10.39315698 7.77905944 12.99706620 -0.01241337 0.00254130 0.05588276 Na 0.01883317 10.39842043 10.42461173 -0.06180746 -0.05158763 -0.02715680 Na 2.60547326 12.94143911 10.35431752 0.03118119 0.09876840 -0.00152188 Na 2.66780268 10.38402746 12.92476337 -0.01765833 -0.03106102 0.08616871 Na 0.05177641 12.93621848 12.97902782 0.05307243 -0.04486621 -0.04460529 Na 5.14079296 10.38452762 10.38361157 0.06274882 -0.04690047 -0.04386065 Na 7.77166205 12.95143700 10.41875254 0.00792203 0.06673734 -0.06124904 Na 7.80635903 10.38134061 12.93292811 -0.02413107 -0.06677720 0.06394328 Na 5.23645401 12.96772935 12.95982687 -0.01805257 0.00887047 0.01145273 Na 10.33020248 10.31255538 10.32636012 0.00284488 0.00136842 0.02032788 Na 12.91400998 12.87077160 10.40497321 -0.00359890 0.02070988 -0.02595437 Na 12.95699628 10.41125365 12.94832274 -0.02186217 -0.05972000 -0.00532275 Na 10.32619956 12.93231514 13.01427437 -0.01536200 -0.01018189 -0.02291387