108 Lattice="19.105604106503606 0.0 0.0 0.0 19.105604106503606 0.0 0.0 0.0 19.105604106503606" Properties=species:S:1:pos:R:3:forces:R:3 energy=-54.709025271316996 stress="-0.11875364166989444 -0.062434241967072646 0.03493239168196016 -0.062434241967072646 -0.13127208123416523 -0.24241935934124825 0.03493239168196016 -0.24241935934124825 -0.16113610019549673" pbc="F F F" Na 0.06111824 0.02754757 0.01052994 -0.04676345 -0.03747763 -0.04001624 Na 3.19349225 3.19788855 0.03185096 0.07958340 0.09168624 -0.08658725 Na 3.13755719 0.00017623 3.21685194 0.09155091 -0.09143947 0.08258957 Na 0.03380406 3.23905867 3.20435389 -0.10849416 0.05708370 0.06025080 Na 6.36534086 -0.03028339 0.05689574 0.01642212 -0.04031168 -0.04174018 Na 9.57290707 3.21317130 -0.00264163 -0.02784757 0.06161112 -0.06717564 Na 9.57731148 0.05712785 3.21362754 -0.05953068 -0.07801714 0.07612188 Na 6.30830109 3.24391238 3.23719671 0.03256884 0.08530713 0.10556704 Na 12.67403082 -0.05157553 -0.03177621 -0.04454606 -0.05820511 -0.06150395 Na 15.94414533 3.13200398 0.03526108 0.05801560 0.04879644 -0.06029718 Na 15.87897105 -0.02981355 3.22597500 0.06383384 -0.06767111 0.05020393 Na 12.68781768 3.12567193 3.22450155 -0.05015420 0.13198588 0.08121305 Na -0.03428066 6.42288490 0.05158605 -0.05594626 -0.00337448 -0.06059184 Na 3.13350728 9.54246023 0.03737254 0.11738768 -0.02511381 -0.06568082 Na 3.12094345 6.43117972 3.24303129 0.16580462 0.02862522 0.06827612 Na -0.01994361 9.60732257 3.18362587 -0.07446862 -0.02455734 0.09872176 Na 6.43377368 6.33257955 -0.02399498 -0.01873139 0.04065824 -0.02768322 Na 9.59407131 9.50779588 -0.00295572 -0.01772843 -0.00212314 -0.05501732 Na 9.56070380 6.31020483 3.18966320 -0.03014521 0.04578771 0.12279510 Na 6.48147930 9.60014415 3.17534139 -0.02522748 -0.06249186 0.10871132 Na 12.78341136 6.31885736 -0.00146915 -0.08057461 0.02649883 -0.06386930 Na 15.94676768 9.61478477 -0.03964514 0.04461555 -0.02661507 -0.04562198 Na 15.92715485 6.38534991 3.13964099 0.06132051 0.00188589 0.08843568 Na 12.70024177 9.50913137 3.20497702 -0.09204283 -0.00962524 0.10148775 Na -0.03493224 12.72593340 0.04469431 -0.06486634 -0.05119000 -0.07928546 Na 3.14143325 15.94506171 0.00380064 0.04777709 0.06856374 -0.06459160 Na 3.23003969 12.74430453 3.17314876 0.09323231 -0.10635021 0.11879066 Na -0.05388733 15.86173891 3.21138642 -0.06012925 0.06988823 0.06271618 Na 6.30787147 12.75545467 -0.03047163 0.03365325 -0.10132092 -0.07400860 Na 9.55327791 15.86652874 0.01160841 -0.00282028 0.05403889 -0.06146898 Na 9.57630377 12.70583728 3.15945851 -0.02797845 -0.09173416 0.11647813 Na 6.37564877 15.93556934 3.12540271 0.01909702 0.06638869 0.11503251 Na 12.79964778 12.74570747 0.03218954 -0.10260429 -0.09015970 -0.08674288 Na 15.87608590 15.87385566 -0.03375250 0.04260193 0.04779965 -0.03057940 Na 15.93179643 12.71906742 3.20625645 0.08177949 -0.08914246 0.08087381 Na 12.70876777 15.90043558 3.23615725 -0.06672739 0.09452084 0.05381933 Na -0.04895183 0.03150569 6.40553423 -0.05371627 -0.05372094 0.01035510 Na 3.12258269 3.20373982 6.32379363 0.14333714 0.09202012 0.04787002 Na 3.15392423 0.04696386 9.60401273 0.08866679 -0.08747482 -0.04532753 Na 0.04701549 3.18728429 9.58926196 -0.10347557 0.07952255 -0.04036734 Na 6.32897852 -0.05860542 6.44683980 0.02982665 -0.03300856 -0.01064071 Na 9.58231336 3.21613789 6.30888142 -0.05725545 0.12026267 0.08204354 Na 9.61448220 -0.00740041 9.56102823 -0.02807142 -0.02734990 -0.01948888 Na 6.34519099 3.12552963 9.50209500 0.05507390 0.16477999 -0.00783805 Na 12.68809138 -0.01815660 6.35285359 -0.05749907 -0.07115910 0.04064074 Na 15.95786721 3.17110157 6.39858370 0.05901547 0.08627839 0.00081811 Na 15.91374393 0.00182520 9.61571252 0.04345899 -0.06033255 -0.02063194 Na 12.76836293 3.17143294 9.54450002 -0.13754801 0.11515897 -0.02239910 Na 0.05184438 6.36685910 6.35634221 -0.08317669 0.03080501 0.03767216 Na 3.19196451 9.49972268 6.38234684 0.14522667 0.01468178 0.03114013 Na 3.12955026 6.32972655 9.56960011 0.18291658 0.04807796 -0.02739750 Na 0.05929942 9.56960930 9.55701106 -0.06185301 -0.02059865 -0.03090243 Na 6.33052695 6.38856905 6.40170780 0.04094539 0.02194356 0.03104578 Na 9.53159829 9.53480655 6.34265605 -0.00613188 -0.02292325 0.04952437 Na 9.56240794 6.42674820 9.57007371 -0.02725405 -0.02068491 -0.05093653 Na 6.44929007 9.60398636 9.55497937 -0.01860103 -0.04413762 -0.03376880 Na 12.74995202 6.37547747 6.36549834 -0.12670092 0.01496985 0.03226922 Na 15.91272341 9.46808911 6.36488166 0.04026841 0.00900071 0.02815772 Na 15.87418981 6.32652565 9.60020547 0.05485762 0.03498779 -0.02271179 Na 12.74798236 9.56845860 9.58648867 -0.12713139 -0.02412078 -0.05967503 Na 0.03544433 12.67686887 6.35559536 -0.05830810 -0.07373143 0.03025306 Na 3.15647700 15.93104052 6.41975218 0.09342924 0.06411678 -0.01383779 Na 3.19994793 12.79677920 9.59412409 0.10106906 -0.13663812 -0.03992174 Na -0.04854842 15.93292238 9.51083734 -0.04998053 0.03753977 0.01060334 Na 6.36701854 12.72906458 6.32808078 0.02050516 -0.10997727 0.02848634 Na 9.59969935 15.95078932 6.39255638 -0.05559757 0.04486091 0.00478726 Na 9.49314515 12.79734086 9.55263692 0.00096855 -0.15225921 -0.03189176 Na 6.34245828 15.86396700 9.54271411 0.02795075 0.06254856 -0.01726819 Na 12.69246971 12.75319697 6.37867738 -0.09662971 -0.15384309 0.02774700 Na 15.92311944 15.85892206 6.32036429 0.06153140 0.06239884 0.02285137 Na 15.96767438 12.73076780 9.55833169 0.06378068 -0.09748934 -0.02747401 Na 12.75902712 15.88200661 9.52186820 -0.07246573 0.07110460 -0.00606893 Na 0.03006089 -0.05466252 12.71436704 -0.07773505 -0.06320455 -0.03473819 Na 3.13693778 3.17672405 12.67932040 0.14476985 0.11390851 -0.04299217 Na 3.20677688 -0.04827343 15.93262396 0.04411713 -0.05464218 0.05410269 Na -0.04365611 3.22356495 15.94695664 -0.04804557 0.04152963 0.05164001 Na 6.40483959 -0.02231083 12.69729375 0.02231300 -0.05799707 -0.07083655 Na 9.57760064 3.23607613 12.78528743 -0.04766860 0.09115031 -0.13681524 Na 9.60448086 -0.05995953 15.96796286 -0.03196934 -0.03711337 0.05005824 Na 6.31454832 3.13873523 15.88131440 0.02452368 0.10105688 0.05599605 Na 12.69464754 0.04538882 12.79834807 -0.06159302 -0.09147553 -0.09547176 Na 15.97405360 3.17287978 12.76536526 0.08818238 0.07111641 -0.08003281 Na 15.87004695 0.03210173 15.96241724 0.04889564 -0.05098660 0.04065526 Na 12.78391255 3.17117612 15.93019136 -0.10145267 0.10003077 0.10063769 Na 0.04171068 6.33984936 12.68940811 -0.08485423 0.03554040 -0.06123751 Na 3.13965391 9.60718443 12.67450622 0.14664415 -0.04618547 -0.10175467 Na 3.14893343 6.44465440 15.94233891 0.10303481 -0.02874493 0.04495952 Na 0.05644911 9.48431026 15.95416694 -0.07392209 -0.00149748 0.05218439 Na 6.40982344 6.44132417 12.73548346 -0.02681533 -0.01643136 -0.14969048 Na 9.61547997 9.49074562 12.72652303 -0.03179682 0.01049710 -0.11283559 Na 9.52157114 6.41188522 15.87423618 0.00524444 -0.00591405 0.07220809 Na 6.34381969 9.46675548 15.92610927 0.01544995 0.02593646 0.04305353 Na 12.75180949 6.32398681 12.75076960 -0.10169592 0.03177087 -0.09912755 Na 15.87742951 9.54814093 12.78175655 0.07562446 -0.02675803 -0.08808440 Na 15.97858563 6.30885043 15.95366387 0.04375387 0.02904554 0.04910279 Na 12.76519503 9.58730081 15.97213961 -0.07628928 -0.04215062 0.06692942 Na -0.05505091 12.68019068 12.77446128 -0.09291044 -0.04749086 -0.08837976 Na 3.22296889 15.90853062 12.76696861 0.04827974 0.08652238 -0.09080117 Na 3.14145584 12.72552458 15.88443577 0.09336178 -0.08631868 0.09281579 Na -0.00916730 15.90326438 15.93226436 -0.03678698 0.03887071 0.03200732 Na 6.40869548 12.67897032 12.74653414 0.02897437 -0.10156757 -0.08712875 Na 9.58766510 15.97653643 12.69163446 -0.02561356 0.05439239 -0.04971365 Na 9.57533817 12.67642287 15.93718188 -0.03625941 -0.06071547 0.04966138 Na 6.30825468 15.90283087 15.93570263 0.04147331 0.04053148 0.04857282 Na 12.69862187 12.67775533 12.68228939 -0.09459501 -0.06493168 -0.07919653 Na 15.93918626 15.92098813 12.69812459 0.05138397 0.06229071 -0.04856810 Na 15.95541893 12.75510717 15.90962601 0.06648147 -0.05620635 0.05814933 Na 12.76868171 15.88772103 15.97453072 -0.06585392 0.05632614 0.04733060