108 Lattice="20.3561948616802 0.0 0.0 0.0 20.3561948616802 0.0 0.0 0.0 20.3561948616802" Properties=species:S:1:pos:R:3:forces:R:3 energy=-77.39353402417751 stress="-0.0001637561934446515 1.6863079554164016e-06 1.2228753030864426e-05 1.6863079554164016e-06 -0.00016326618945332956 8.119516230994854e-06 1.2228753030864426e-05 8.119516230994854e-06 -0.00013921844088930549" pbc="F F F" Rb 0.06592301 0.03933985 0.02598321 0.02564644 0.03512401 0.02680331 Rb 3.42806485 3.35959329 0.06072235 0.00642776 0.02831620 -0.04820395 Rb 3.39613449 0.02046803 3.36078680 0.00598604 -0.03785520 0.04419023 Rb 0.01922144 3.39818589 3.42183120 -0.04612930 0.00567575 0.01346246 Rb 6.75428031 0.06606210 0.11824870 0.00628108 -0.01587147 -0.00157543 Rb 10.15837557 3.35941141 0.03637643 0.00081455 0.04820051 -0.03847528 Rb 10.23092371 0.06532231 3.45504605 0.00684633 -0.03763250 0.00983668 Rb 6.77972330 3.42791312 3.42810930 0.00566632 0.02204907 0.01789854 Rb 13.55275005 0.05347947 0.04338370 -0.01748321 -0.00625609 -0.00383874 Rb 16.95711588 3.45348069 0.06259638 0.00850932 0.02403525 -0.00938661 Rb 16.91890529 0.02120866 3.36323049 0.01005471 0.00259330 0.02406078 Rb 13.60798737 3.35587709 3.36869056 -0.02446525 0.04052251 0.03532920 Rb 0.00762773 6.71786231 0.02871878 0.00428580 -0.00871927 -0.00448041 Rb 3.38600510 10.15044448 0.06705213 0.00822757 0.01459989 -0.04488039 Rb 3.36109818 6.73536225 3.33536768 0.01752581 0.01877634 0.05826504 Rb 0.03796452 10.24247325 3.41539438 -0.04643547 -0.01972363 0.02124306 Rb 6.72004513 6.76673036 0.00893509 0.01411605 -0.01033797 -0.03974325 Rb 10.23859609 10.15081670 0.01791137 -0.00424623 0.00400176 -0.03617252 Rb 10.24560134 6.79282985 3.44332830 -0.00825319 -0.01883425 -0.00660702 Rb 6.82093349 10.21092087 3.34285542 -0.01879531 -0.02131681 0.03571879 Rb 13.63413999 6.82019589 0.06712605 -0.03571883 -0.03560375 -0.05257289 Rb 16.90771194 10.12759194 0.10852351 0.02801725 0.00540944 -0.01517531 Rb 16.94279226 6.76220427 3.44925557 0.04869374 -0.01788833 0.02300211 Rb 13.62944490 10.13807495 3.32805865 -0.02736929 0.03379063 0.07778629 Rb 0.06287030 13.56938442 0.02954370 -0.00534561 -0.02239805 -0.00236302 Rb 3.33913962 16.89602901 0.00729585 0.03954133 0.01182868 0.01049025 Rb 3.36922262 13.57666384 3.42119675 0.03836074 -0.01297480 0.01148237 Rb 0.05288440 16.93911400 3.43321611 -0.01218930 -0.00489896 0.02353216 Rb 6.74760291 13.60414728 0.05657759 -0.00523671 -0.02083310 -0.04013978 Rb 10.14844163 16.96760773 0.01318174 0.01038167 -0.00352538 0.00313536 Rb 10.19501469 13.56913698 3.38430114 0.01100915 -0.00797115 0.00592329 Rb 6.76536224 16.99245020 3.44896262 -0.00537530 0.03124507 0.01203853 Rb 13.59948864 13.56612821 0.01844614 -0.01584831 -0.01001223 -0.03828186 Rb 16.95321355 16.95330326 0.00694895 -0.02615491 -0.01751410 0.02768314 Rb 17.00565249 13.63271792 3.39202273 0.02590638 -0.02368218 0.03394887 Rb 13.58780783 16.95226737 3.40444753 -0.02664156 0.03554006 0.01042947 Rb 0.05565405 0.03933725 6.76394851 -0.01720638 -0.01351031 -0.01926124 Rb 3.33926237 3.37568869 6.76934941 0.04449233 0.01422311 -0.01147026 Rb 3.40575149 0.04773733 10.11168978 0.02221335 -0.05522151 0.01070581 Rb 0.03267217 3.37594280 10.15037139 -0.04009966 0.01076133 0.00727792 Rb 6.83397453 0.02067420 6.67304144 -0.01554304 -0.02951862 0.00462209 Rb 10.17811693 3.46702159 6.84951968 0.01514637 -0.00494095 -0.00926778 Rb 10.21798985 0.00761279 10.17318622 0.00693059 -0.03216014 -0.01731906 Rb 6.74320057 3.37244324 10.18871177 0.00639365 0.00932294 -0.00534120 Rb 13.62617353 0.00666884 6.71894151 -0.03451432 -0.02688683 0.01218715 Rb 16.96461205 3.39905447 6.82923750 0.05503995 0.01171401 -0.01496376 Rb 16.89708137 0.03299043 10.18499604 0.00826014 -0.01774398 -0.00274817 Rb 13.61782414 3.42632647 10.11978038 -0.03346268 0.01565993 0.02763758 Rb 0.05141945 6.76181086 6.82996625 -0.05126354 0.00299387 -0.02898435 Rb 3.39688890 10.22099587 6.79954667 0.04415609 -0.00361748 -0.02777455 Rb 3.32621900 6.81028515 10.11199504 0.05104136 -0.02000698 0.03176252 Rb 0.04282108 10.11449626 10.14060425 -0.04919611 0.01573450 0.00591769 Rb 6.77312602 6.73016435 6.84974903 -0.02375737 0.01635890 -0.01330184 Rb 10.18091660 10.15059584 6.72286085 0.00280381 0.01351060 0.00711279 Rb 10.16296445 6.84642197 10.20810071 0.03026489 -0.00861622 0.00370866 Rb 6.79732938 10.18926832 10.22185587 -0.02030808 0.02236627 -0.01051993 Rb 13.63169612 6.71831305 6.80101526 -0.02698118 0.01250349 -0.02464743 Rb 17.01229134 10.17336912 6.79074362 0.03550636 -0.00487080 -0.02867811 Rb 16.89681843 6.82837891 10.22614616 0.07085792 -0.02016132 0.00132652 Rb 13.61233828 10.07239069 10.10640979 -0.03068631 0.02455518 0.02192990 Rb 0.05618244 13.54969770 6.79458441 -0.06238619 -0.01697145 0.00799973 Rb 3.34982019 16.91999521 6.73183871 0.03256867 0.04758155 -0.00042584 Rb 3.37442367 13.63226633 10.15725921 0.02659750 -0.04139476 0.00922843 Rb 0.05718285 16.94839962 10.11686760 -0.00205338 0.01654414 0.01098340 Rb 6.83622500 13.63571972 6.81498673 -0.01060487 -0.04377481 -0.00915158 Rb 10.19288854 16.89638856 6.84617628 0.02508235 0.04611327 -0.01304559 Rb 10.24563204 13.53359804 10.28566149 -0.01072161 -0.01278035 -0.01483493 Rb 6.76540792 16.98332908 10.09831320 -0.00074031 0.03696058 0.00842413 Rb 13.60688262 13.59604069 6.84859682 -0.02558261 -0.02628768 -0.01811844 Rb 16.91219622 17.02097421 6.77823297 0.00030708 0.00505380 0.00046064 Rb 16.96985448 13.54958811 10.11521034 0.02521964 -0.01093619 0.01116142 Rb 13.55437639 17.02304064 10.19090788 -0.00443870 0.04559353 0.00692001 Rb 0.02741057 0.00170699 13.61785236 0.00350346 0.01830554 -0.03768978 Rb 3.45136969 3.34326211 13.55271273 -0.00371451 0.02024154 -0.02240787 Rb 3.34208224 0.01925543 16.95939855 0.04603808 -0.00601145 0.01004437 Rb 0.10563085 3.37966847 16.99109322 -0.00621689 0.02648891 0.00183377 Rb 6.81654424 0.02647568 13.60897466 -0.00876313 -0.05406798 -0.02301372 Rb 10.18700205 3.40406180 13.61891466 -0.00418823 0.00209302 -0.04513686 Rb 10.12193311 0.00355310 17.01387276 0.02762524 0.01055022 -0.00567293 Rb 6.73388912 3.34220559 16.93908387 -0.00065726 0.04328351 0.03890986 Rb 13.61196899 0.06242516 13.52371246 -0.04647189 -0.03566776 0.01252333 Rb 16.99740737 3.32493873 13.58325115 0.03119639 0.04202619 -0.01977597 Rb 16.90102931 0.02061130 16.96791201 -0.02526278 0.02753752 -0.02145703 Rb 13.55023741 3.39626908 16.97543100 0.00119776 -0.00098824 0.03801488 Rb 0.05292172 6.69583455 13.52725525 -0.04272167 0.00163751 -0.00865176 Rb 3.33531188 10.18170860 13.62857041 0.03417203 -0.00209687 -0.03084561 Rb 3.39082297 6.70728926 16.90485301 0.02485422 0.00858183 0.04008218 Rb 0.00552942 10.17351330 16.97321340 0.00014213 -0.01315327 -0.00156770 Rb 6.80004722 6.82653361 13.46446206 -0.01958715 -0.01207448 0.02378451 Rb 10.20425604 10.23704197 13.61531285 0.00808460 -0.01712398 -0.00918425 Rb 10.24033790 6.72332707 16.93429979 -0.01625830 0.00665665 0.03546160 Rb 6.81591075 10.14484697 17.00715314 -0.00286140 -0.00694554 0.02169755 Rb 13.61528705 6.79843774 13.60392621 -0.02290993 -0.02104657 -0.01618553 Rb 16.98197755 10.15666281 13.57541822 0.02570424 0.03506690 -0.01215009 Rb 16.98605520 6.75550205 16.95898972 -0.01312714 -0.00427938 -0.00710421 Rb 13.56995127 10.23628875 16.95188097 -0.00714392 -0.00532435 0.04244169 Rb 0.04501225 13.51869191 13.50488013 -0.03724052 0.01299248 -0.00626509 Rb 3.45584999 16.93810271 13.58751288 0.00745423 0.04499865 -0.01469653 Rb 3.39093743 13.58787976 16.92324344 0.01320719 -0.00241836 0.04795551 Rb 0.02187226 17.01156292 16.91119715 0.02718337 -0.03548068 -0.03791213 Rb 6.73565808 13.59716936 13.59549152 0.00847367 -0.02211163 -0.01843143 Rb 10.14750126 16.98251666 13.61899149 -0.01937666 0.03598341 -0.04508567 Rb 10.21746127 13.59442842 16.91963825 -0.01954989 -0.01355475 0.03829301 Rb 6.84760289 17.03121176 17.00211409 0.00493769 -0.00551466 0.01118082 Rb 13.55481208 13.63454785 13.53408932 0.03570914 -0.02187669 -0.00109747 Rb 17.01198998 16.92337205 13.58333965 -0.01727683 -0.01506880 -0.01272156 Rb 17.01550753 13.54054568 17.00662789 -0.03045009 -0.00658886 -0.01159025 Rb 13.45784032 16.99788044 17.02968505 0.00434875 -0.02105944 -0.01745546