256 Lattice="22.05378934025039 0.0 0.0 0.0 22.05378934025039 0.0 0.0 0.0 22.05378934025039" Properties=species:S:1:pos:R:3:forces:R:3 energy=-254.67865292464535 stress="-2.3441713669717908e-05 -3.194241064205256e-05 1.915586009639771e-06 -3.194241064205256e-05 -3.0018934695967245e-05 -5.680402653004493e-05 1.915586009639771e-06 -5.680402653004493e-05 -3.536395407026052e-05" pbc="F F F" Na 0.00775511 0.02332825 0.02800869 0.05481025 0.05776471 0.06468497 Na 2.77900022 2.75635657 0.02545849 -0.03012349 -0.01986580 0.00130540 Na 2.78943588 0.01072766 2.79628248 -0.04014574 0.00065120 -0.03806462 Na 0.01757482 2.80793014 2.80254623 0.00792816 -0.05422629 -0.03180661 Na 5.55876387 0.00533855 0.02550776 -0.01167665 0.03418778 0.02356000 Na 8.30545309 2.79037831 0.06775261 -0.03833164 -0.02498304 -0.01749244 Na 8.24782232 0.04459671 2.78336804 0.03548939 -0.02086324 -0.02973698 Na 5.46459121 2.73544612 2.78424728 0.03302352 0.00653170 -0.03215576 Na 11.06294084 0.04279613 0.00980506 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0.01239035 0.01854460 -0.02024472 -0.01629120 Na 8.24959957 13.82157537 0.05427422 0.02929514 -0.04803110 -0.01346901 Na 8.27966698 10.99191839 2.80996555 -0.01705123 0.04491106 -0.05019832 Na 5.47922352 13.78807196 2.70178795 0.02683376 -0.03738169 0.05770555 Na 11.07602533 11.01978324 0.02261653 -0.03809207 0.02706118 0.00315968 Na 13.74069655 13.82896787 0.05490743 0.04742332 -0.01872952 -0.02932591 Na 13.81876544 11.06897125 2.79550894 -0.02953221 0.00067041 -0.04812773 Na 11.02993751 13.79646902 2.79241249 -0.00564849 -0.01957889 -0.02363164 Na 16.58491686 11.06458756 0.06987617 -0.03242792 -0.01561408 -0.02696986 Na 19.28933105 13.79961661 0.07797174 -0.00818901 0.01843488 0.00030151 Na 19.30834207 11.04885816 2.73034779 0.02556319 -0.01561240 0.03026160 Na 16.56151884 13.80630966 2.79464206 0.01158201 -0.00862511 -0.02584016 Na 0.03087051 16.58849366 0.04946383 0.01259083 -0.01602308 0.01819265 Na 2.72014236 19.27030149 0.01861690 0.02862190 -0.02226415 0.02535029 Na 2.80591880 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0.04250408 0.02248476 5.54732964 0.02567734 0.02489145 0.00047773 Na 2.77056510 2.75869563 5.54633941 0.00016528 -0.04160546 0.00420491 Na 2.79541383 0.03541353 8.31329510 -0.02808265 -0.02373570 -0.02584995 Na 0.03592922 2.77530057 8.24688388 -0.02359893 -0.03126302 0.02979031 Na 5.53846730 0.00293517 5.57335159 -0.01673929 -0.02493979 -0.01253224 Na 8.24569050 2.71484212 5.50013625 0.02649155 0.03770312 0.00459648 Na 8.28921179 0.04305737 8.31912971 0.02560413 -0.03131565 -0.01072813 Na 5.54005782 2.69774572 8.32094920 0.01560011 0.04058799 -0.04666203 Na 11.07213902 0.04690039 5.50545303 -0.03767663 -0.00836037 0.01307877 Na 13.74312919 2.80595750 5.50581929 0.02495329 -0.04100653 0.01116552 Na 13.73307275 0.09444386 8.30702309 0.04094751 -0.01035990 -0.04167451 Na 10.99682944 2.79219526 8.30880949 0.00948537 -0.01371536 -0.03272287 Na 16.53427137 0.00556933 5.54650533 -0.00094824 0.01915018 -0.01377976 Na 19.26994737 2.75961521 5.46037169 0.02171805 -0.02501871 0.02683398 Na 19.30434362 0.00042213 8.31783755 -0.02464496 0.04098599 -0.01658282 Na 16.60296069 2.76495719 8.29329750 -0.02957364 -0.03735808 -0.01618694 Na 0.04212916 5.47847585 5.60379936 -0.01501582 0.02960227 -0.03159098 Na 2.77095650 8.30349909 5.48304528 -0.02502173 -0.04550821 0.02060827 Na 2.79507393 5.46129510 8.28123512 -0.01627025 0.03452925 -0.01902425 Na 0.08111257 8.27608974 8.22068336 -0.02176189 0.00694543 0.03246931 Na 5.48108455 5.53099743 5.52848746 0.03277210 -0.02043975 0.01114079 Na 8.26835343 8.26661168 5.51604361 -0.02052854 -0.01553628 0.00393192 Na 8.29513196 5.50654002 8.29118812 -0.05042182 -0.00889336 -0.03565632 Na 5.47485496 8.27799771 8.24168511 0.02161865 -0.03595813 0.01768573 Na 10.98224451 5.55287295 5.51099678 0.03231432 -0.03371428 -0.01558952 Na 13.82253892 8.29019334 5.43627668 -0.02190591 -0.01908643 0.05373528 Na 13.84935198 5.49644512 8.23634703 -0.04660015 -0.00467964 0.02256605 Na 11.05384209 8.26562133 8.22024708 0.01456698 -0.02422559 0.03264665 Na 16.55153469 5.47252669 5.55057609 0.01674644 0.03486441 -0.04193068 Na 19.29347291 8.22661415 5.49869022 0.00574431 0.04969137 0.01524670 Na 19.24833859 5.52270688 8.22399256 0.04925110 -0.00827868 0.02096139 Na 16.50026505 8.22312169 8.25362092 0.06904710 0.07300888 0.00160143 Na 0.02622761 10.99961567 5.52457460 -0.02069662 0.03208676 -0.02818557 Na 2.74280342 13.78534863 5.46937673 0.03701600 -0.01242305 0.02888942 Na 2.78643775 11.01698301 8.24877114 -0.03853153 0.03086247 0.01194853 Na 0.05779359 13.82836522 8.21697050 -0.01611817 -0.03333725 0.01758116 Na 5.54771150 10.97516115 5.54235077 -0.01038631 0.07634059 -0.01575715 Na 8.27191030 13.84969553 5.47089025 -0.01219392 -0.04842100 0.04365371 Na 8.32324519 10.97622121 8.22404922 -0.01621141 0.05355634 0.02311912 Na 5.49301792 13.81740693 8.30782020 0.02387723 -0.04626604 -0.07598774 Na 11.06240287 11.01715545 5.53675680 -0.01740642 0.02463381 -0.02232261 Na 13.75453883 13.83706587 5.56832218 0.02961937 -0.06518931 -0.03286501 Na 13.72911790 10.99306821 8.30919296 0.05951538 0.02891763 -0.04628870 Na 11.03543938 13.76189748 8.29084086 -0.04501129 0.01696735 -0.00387122 Na 16.54861882 10.99961898 5.47181861 0.01686328 0.03908047 0.06235331 Na 19.29391618 13.76320483 5.54307293 0.01667693 0.03837726 -0.03536409 Na 19.31765885 11.06146728 8.27837084 -0.02613017 -0.03972593 -0.02556141 Na 16.50906729 13.80969426 8.24523326 0.05506671 -0.01332925 0.00955088 Na 0.01332325 16.52327171 5.48951128 0.01792335 0.04382489 -0.01136378 Na 2.77140592 19.33646676 5.56760012 -0.00421167 -0.03087477 -0.05480898 Na 2.79899106 16.53462266 8.29443788 -0.03784554 0.03983657 -0.03693763 Na 0.04075040 19.25734735 8.21914601 0.03418383 -0.03596730 0.04092269 Na 5.52531947 16.58612229 5.48085246 -0.04135848 -0.01339978 0.02898756 Na 8.24413442 19.24215493 5.46614526 -0.00125284 0.02114440 0.04970597 Na 8.23541539 16.55114170 8.27149234 0.05370327 0.02414338 -0.01813487 Na 5.46803220 19.29493557 8.34486800 0.03626608 0.01895420 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0.04214921 -0.05595918 Na 19.30789471 19.26906078 11.04982672 -0.03857351 -0.01794239 0.01540008 Na 19.25401043 16.51741150 13.76392017 0.01994799 0.02335114 0.04749143 Na 16.49956032 19.26358154 13.83247312 0.04582704 0.01700839 -0.03833312 Na 0.00210434 0.00506277 16.61686596 0.04350194 0.07220760 -0.01048666 Na 2.81047199 2.78954225 16.59298810 -0.08499060 -0.06067224 -0.01913312 Na 2.73802967 0.01812771 19.32776990 -0.01229909 0.03607711 -0.02686988 Na 0.02993335 2.80993437 19.31751234 0.02805599 -0.02919009 -0.02853853 Na 5.50801713 0.03959188 16.61930413 0.02052249 -0.04037556 -0.04909366 Na 8.23803081 2.79671768 16.52855061 0.05949402 -0.04679898 0.04327282 Na 8.24974255 0.03607632 19.32938898 0.01868026 0.02109856 -0.03006569 Na 5.51876688 2.71336455 19.24217492 0.00744772 0.03405846 0.05202926 Na 10.97818101 0.00861565 16.53940723 0.03956325 0.01737583 0.03458863 Na 13.82335710 2.80233321 16.51278589 -0.01772737 -0.05220503 0.08152207 Na 13.81832754 0.00336767 19.29046231 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16.54743568 -0.01006454 -0.05447015 0.02362306 Na 13.82015398 8.31203871 16.49126998 -0.02617165 -0.02478734 0.05598392 Na 13.74100387 5.56824396 19.33559285 0.03872298 -0.03578283 -0.02326028 Na 11.03780848 8.25024437 19.25707882 -0.00790080 0.04815571 0.04312800 Na 16.53486351 5.55571115 16.50370119 0.03915768 -0.00009914 0.07931971 Na 19.33730045 8.28521710 16.60095736 -0.02063322 -0.00091563 -0.00467798 Na 19.34936382 5.48246045 19.32798944 -0.04394738 0.01394286 -0.05020277 Na 16.56121441 8.24022102 19.34436144 0.01099566 0.01583580 -0.02048449 Na 0.04272809 11.01307630 16.56784629 -0.02532612 0.00669767 0.00063552 Na 2.75136779 13.77197728 16.57296109 0.00772602 0.02518379 -0.02711654 Na 2.79600294 10.99258629 19.24833716 -0.01157533 0.02299313 0.03949340 Na 0.01315651 13.73625314 19.26909950 0.03379276 0.00925723 -0.00588745 Na 5.48322726 11.06672552 16.52425473 0.05129793 -0.03177133 0.02541656 Na 8.21979908 13.83457564 16.59483188 0.07552096 -0.03884893 -0.04936789 Na 8.22018079 11.07597408 19.32654318 0.01617890 -0.04173604 -0.01189471 Na 5.53283607 13.82642533 19.28763226 -0.02069735 -0.01750858 0.03027674 Na 11.06634608 11.00057189 16.57779999 -0.06848561 0.02372383 -0.01572405 Na 13.72853085 13.76256912 16.52798783 0.04530014 0.01418595 0.03290116 Na 13.75001235 11.04874093 19.27245433 0.04853522 -0.03223468 0.02707650 Na 11.01193605 13.74438552 19.33848060 0.01416493 0.04869864 -0.01622849 Na 16.52710359 10.97032285 16.51665360 0.03747085 0.03127299 0.05891187 Na 19.33418501 13.74867191 16.54722877 -0.01870824 0.03784547 0.02763759 Na 19.30191691 11.05337317 19.35185701 -0.03860938 -0.02287357 -0.04651233 Na 16.58258021 13.75374912 19.22969595 -0.02096068 0.01903242 0.00492187 Na 0.00149849 16.52362418 16.58069429 0.01285751 0.04118992 -0.00529969 Na 2.79937635 19.33723107 16.57423725 -0.05271866 -0.01532055 -0.01160624 Na 2.80944806 16.52137485 19.28618390 -0.06625347 0.02570636 0.00186703 Na 0.04193063 19.27345500 19.24315803 0.04822044 -0.03289355 -0.02341441 Na 5.55922018 16.58988143 16.58278788 -0.03037313 -0.01036228 -0.04069944 Na 8.25916269 19.33960241 16.57975848 0.00715921 -0.02820157 -0.01395326 Na 8.31300557 16.52533859 19.34632271 -0.01883309 0.05493407 -0.00521836 Na 5.46343690 19.30420775 19.26608948 0.03456245 -0.02573460 0.00978626 Na 11.04885535 16.59802896 16.54202907 -0.04838044 -0.03124436 0.01369895 Na 13.79779711 19.24545802 16.49182317 -0.05061121 0.05223011 0.04818587 Na 13.82141386 16.58589242 19.25195066 -0.03633518 -0.03565224 0.02771297 Na 11.00343278 19.31358117 19.34849246 0.03181070 -0.03499340 -0.05609932 Na 16.48781396 16.56490332 16.55560687 0.09104071 -0.03839536 -0.00834198 Na 19.32031828 19.30111071 16.55419054 -0.05335222 -0.05024646 -0.00980921 Na 19.25432893 16.59348519 19.31070883 -0.04093475 -0.01641058 -0.04959683 Na 16.51266340 19.30769605 19.24228465 0.02571716 -0.00432250 -0.03044406