256 Lattice="22.053791046142578 0.0 0.0 0.0 22.053791046142578 0.0 0.0 0.0 22.053791046142578" Properties=species:S:1:pos:R:3:forces:R:3 energy=-254.70680944701314 stress="-8.821616431059831e-05 -2.4945924549764387e-05 -5.349471845007523e-06 -2.4945924549764387e-05 -8.725901248173566e-05 8.172224987729142e-06 -5.349471845007523e-06 8.172224987729142e-06 -0.00011120370072800061" free_energy=-254.70680944701314 pbc="F F F" Na 0.03615625 0.03155786 0.02905416 0.02988574 0.01207158 0.02637229 Na 2.72309724 2.75567621 0.04169041 0.02571439 0.00067684 -0.02661654 Na 2.70731747 0.06690081 2.80552646 0.04028293 -0.01503354 -0.04115267 Na 0.02866923 2.75382283 2.70380349 -0.02998888 0.00926971 0.02976504 Na 5.47474390 0.00501442 0.04760440 -0.02855673 0.02255815 0.02473430 Na 8.23345562 2.70330771 0.00390266 0.04147908 0.02956029 0.00486384 Na 8.24495081 0.01404687 2.71929191 0.02218876 -0.01606421 0.01558112 Na 5.56628749 2.77593974 2.77886885 -0.04749094 -0.03312224 -0.02071535 Na 11.07302563 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0.05304870 8.22587565 13.83299302 -0.04442013 0.05382384 -0.01594681 Na 5.56490772 5.56600323 11.05919590 -0.05572836 -0.04338747 -0.03903907 Na 8.30843465 8.21603618 10.98355590 -0.01694031 0.06831225 0.02939982 Na 8.24128990 5.56810769 13.77852700 0.03991813 -0.06422138 0.03758018 Na 5.58599414 8.23567699 13.84433731 -0.03547113 0.08044344 -0.02753287 Na 10.98354896 5.54557800 11.02967613 0.04714139 -0.07384202 0.01533874 Na 13.74170882 8.26664704 11.07076738 0.03393826 0.01284411 -0.00950764 Na 13.82015044 5.46428462 13.83147572 -0.05952203 0.03211526 -0.04029083 Na 10.97875354 8.28437041 13.76281109 0.03102237 -0.00739250 0.03496742 Na 16.50776107 5.47071911 11.07985973 0.02788297 0.02074682 -0.07232287 Na 19.24998733 8.21909598 11.00214644 0.02468484 0.01548578 -0.00653589 Na 19.31256018 5.47699348 13.76459407 0.02371414 0.01766132 0.01656782 Na 16.63056566 8.23685449 13.75712511 -0.05649706 0.01796073 0.04328094 Na 0.04592722 11.09965385 11.06619551 -0.02798488 -0.03116144 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16.49923050 11.07042779 -0.00004275 0.04149315 -0.02787652 Na 19.27394536 19.27388045 11.00954596 -0.02363556 -0.02836423 -0.00625119 Na 19.28809357 16.54400002 13.74713727 0.01542693 0.04140008 0.02603705 Na 16.49218945 19.32726843 13.75500593 0.07636326 -0.01303534 0.03260682 Na 0.00192473 0.04014555 16.55269616 0.03209951 0.00138060 0.02874656 Na 2.70661399 2.71720397 16.55620866 0.04045245 0.02552564 0.01087330 Na 2.78981892 0.02149654 19.34025797 -0.01276186 0.02773361 -0.05473451 Na 0.02321980 2.75117814 19.27926936 0.02269293 -0.01060200 -0.01140704 Na 5.52062319 0.03243613 16.50273571 -0.02818401 -0.02017140 0.03149356 Na 8.28218192 2.71857591 16.52257956 -0.02946781 0.05112757 0.02221946 Na 8.20176331 0.08957660 19.25488541 0.00338200 0.00169374 -0.00949543 Na 5.47092161 2.78146383 19.29352271 0.01471743 -0.00633881 -0.01509373 Na 10.99108745 0.04133014 16.50260505 0.04828802 -0.01164558 0.08307934 Na 13.83143828 2.77987160 16.50869020 -0.04019133 -0.07825053 0.06041478 Na 13.81071910 0.00139067 19.31426472 -0.00720200 0.06960623 -0.07367150 Na 10.97239383 2.74689145 19.32723091 0.07445291 -0.03492315 -0.01570084 Na 16.59544294 0.03654456 16.53776557 -0.00636509 -0.00363011 0.03360976 Na 19.27271357 2.75977177 16.50774604 0.03332408 -0.01069052 0.06012273 Na 19.29604451 0.03505273 19.34870868 -0.04171996 0.04861263 -0.06028563 Na 16.60365574 2.78663593 19.25438067 -0.01400835 -0.05523755 0.03142075 Na 0.03715434 5.49238745 16.55832990 -0.02420485 -0.01187411 -0.00325979 Na 2.72674478 8.24408839 16.50668490 0.03562966 0.02440584 0.06151319 Na 2.74382656 5.49607250 19.27956046 0.00976763 0.02048825 0.01095888 Na 0.01594377 8.21913822 19.29300907 0.01471788 0.00580089 -0.02656413 Na 5.54676996 5.56066506 16.55992637 -0.04322324 -0.06586334 0.02353211 Na 8.25819522 8.22827777 16.63556314 0.04736701 0.03541186 -0.04147110 Na 8.31441241 5.47222162 19.25510231 -0.01605817 0.00213900 0.04024074 Na 5.56731742 8.27558320 19.29320773 -0.06504978 -0.01935978 0.01236603 Na 11.06818732 5.46902010 16.57966180 -0.03076906 0.01945058 -0.02912647 Na 13.73849130 8.28456627 16.49475764 0.06690721 -0.02809747 0.01503197 Na 13.83844385 5.47339871 19.25531734 -0.02609920 0.02937255 0.01891910 Na 11.06608649 8.32485043 19.27960564 -0.00380510 -0.05518466 0.03321173 Na 16.55439797 5.46280568 16.54547824 0.04232796 0.07984167 0.00498782 Na 19.31233094 8.32007108 16.57455178 0.00602268 -0.05366950 -0.02292980 Na 19.27176572 5.53704529 19.33405216 -0.02379150 0.00196325 -0.04925911 Na 16.54528299 8.30486513 19.28932819 0.00375577 -0.03985782 0.00009618 Na 0.04290156 11.05229562 16.61950137 -0.03547466 -0.02790409 -0.03931547 Na 2.72951160 13.84235529 16.54217963 0.00886583 -0.02674173 0.03131211 Na 2.72363395 10.98828485 19.27020931 0.02483403 0.00919460 0.01071580 Na 0.00863850 13.76605817 19.26514702 0.02853270 0.03488287 -0.00490571 Na 5.51641202 11.06345553 16.55663890 -0.01439045 -0.04562262 0.01551040 Na 8.31416939 13.81632252 16.51661387 -0.00972165 -0.01523193 0.06209322 Na 8.22794947 10.99087257 19.33219299 0.02872058 0.04240997 -0.00755370 Na 5.50735997 13.76538589 19.24922714 -0.01073233 0.01927395 0.00647564 Na 11.03061103 10.98174595 16.57565981 -0.01148624 0.06049490 -0.00671053 Na 13.81715720 13.76582978 16.54855855 -0.05923845 0.02119708 0.02109512 Na 13.82197297 11.00928900 19.25977358 -0.02342815 0.02253684 0.02631854 Na 10.97709192 13.76570923 19.35157421 0.05465314 -0.00069412 -0.02513928 Na 16.57975267 10.99606976 16.59471213 -0.00803862 0.01777483 -0.04358346 Na 19.24205410 13.80026400 16.49961034 0.03159793 -0.00950395 0.05793704 Na 19.29127211 11.04353283 19.24831770 -0.01259451 0.02540565 0.00645746 Na 16.50835714 13.77810774 19.32852923 0.05538065 0.01043677 -0.00633058 Na 0.04142914 16.57351783 16.54567001 -0.02798144 0.02556651 0.01802213 Na 2.77483955 19.26528968 16.58435366 -0.05606309 0.02051093 -0.03027964 Na 2.74433188 16.59436854 19.25395700 -0.01300790 -0.01928902 0.03994282 Na 0.00387873 19.34251965 19.34806103 0.05211148 -0.05540793 -0.06311873 Na 5.51172842 16.56763527 16.52761306 0.00778532 -0.01348709 0.02666797 Na 8.24204366 19.24758664 16.56550305 0.01267068 0.02943269 0.01098077 Na 8.25984633 16.51795340 19.34451308 -0.02162321 0.02324590 -0.00627916 Na 5.50945833 19.29945428 19.24830656 0.01279747 -0.01936067 0.00147034 Na 11.00674561 16.57787304 16.59479937 0.03115999 -0.02805311 -0.01454150 Na 13.82875372 19.26692388 16.58270425 -0.03691745 0.02835525 -0.01117989 Na 13.83873766 16.58026021 19.24389324 -0.04837137 -0.03081332 0.02928636 Na 10.99811572 19.26375465 19.31672174 0.01194199 -0.01746632 -0.02447716 Na 16.56260452 16.49787900 16.51601958 0.05123057 0.08974098 0.04477350 Na 19.34356155 19.32856332 16.59075542 -0.08219872 -0.08611255 -0.02160981 Na 19.34762308 16.50077134 19.33493433 -0.07468144 0.01940970 -0.06953183 Na 16.55034915 19.27491661 19.28765216 0.05286376 -0.04155791 -0.02941574