256 Lattice="33.1317253112793 0.0 0.0 0.0 33.1317253112793 0.0 0.0 0.0 33.1317253112793" Properties=species:S:1:pos:R:3:forces:R:3 energy=-111.81625212133835 stress="-4.5485613897891156e-05 1.9491058798655795e-06 -5.365432340428121e-07 1.9491058798655795e-06 -4.3821562942252376e-05 2.0283296975322774e-06 -5.365432340428121e-07 2.0283296975322774e-06 -4.712142262542935e-05" free_energy=-111.81625212133835 pbc="F F F" Rb 0.05431805 0.04740983 0.04364848 -0.04411275 -0.04674609 -0.04413841 Rb 4.09094788 4.12375436 0.00780408 0.07249774 0.04847863 -0.07815252 Rb 4.06724170 0.01877259 4.21478247 0.07634100 -0.07805109 0.03645987 Rb 0.04307020 4.12005396 4.12432827 -0.08866343 0.05651940 0.05552355 Rb 8.24092333 0.00753323 0.07151677 -0.00318783 -0.05443723 -0.05206161 Rb 12.36923798 4.06121778 0.00399496 0.01532408 0.07644304 -0.06836772 Rb 12.36614559 0.02110281 4.08523108 0.00933631 -0.07145330 0.07188805 Rb 8.41714124 4.17033392 4.17473437 -0.01525920 0.06563642 0.06946056 Rb 16.57537131 0.00436253 0.00533526 -0.00146619 -0.04852796 -0.04205953 Rb 20.67026278 4.09613557 0.08153544 -0.01522300 0.05352885 -0.07965480 Rb 20.78253479 0.07494533 4.12075564 -0.03962110 -0.07776920 0.06501988 Rb 16.48106931 4.19712533 4.19131771 -0.00552646 0.06022070 0.06221173 Rb 24.83374941 0.01295549 0.07587716 -0.02557650 -0.07025478 -0.07646467 Rb 28.98415714 4.18557510 0.03546747 0.06241543 0.03827082 -0.06653081 Rb 29.04515865 0.06721043 4.13847285 0.06953024 -0.06859831 0.02828384 Rb 24.84892461 4.07938953 4.05954871 -0.05534948 0.10038821 0.08787193 Rb 0.06686384 8.25514718 0.03721985 -0.06147712 0.01451367 -0.05110890 Rb 4.06781402 12.40166295 0.06810644 0.06912672 0.00360320 -0.06592259 Rb 4.17315681 8.20457760 4.14670620 0.07343043 0.02902499 0.07852749 Rb 0.04586922 12.53613954 4.10802848 -0.06527501 -0.02217468 0.07198290 Rb 8.30271627 8.30783698 0.03842872 0.01270925 0.00930682 -0.05552392 Rb 12.41246311 12.48300488 0.00066240 0.01672651 -0.00396177 -0.03555852 Rb 12.37384531 8.34787039 4.20889414 0.02273270 0.01981177 0.06170167 Rb 8.30826858 12.39372347 4.14554396 0.01091241 0.01885420 0.07860957 Rb 16.64745902 8.23910165 0.00166061 -0.03893463 0.01329003 -0.05417916 Rb 20.62847500 12.38443849 0.03526073 0.00177616 0.00604398 -0.06044073 Rb 20.62306074 8.22965901 4.07594614 0.00685796 0.02411440 0.11014480 Rb 16.61011165 12.31063979 4.18045217 -0.02811825 0.01246161 0.08574576 Rb 24.77027986 8.27662830 0.01293175 -0.04038356 0.01770411 -0.07131266 Rb 29.00203044 12.55234116 0.00219574 0.04120188 -0.00828849 -0.04733268 Rb 28.91859545 8.33876550 4.14598197 0.06781720 0.00360302 0.04719830 Rb 24.81242839 12.38520850 4.07927525 -0.07192707 0.01226510 0.07497867 Rb 0.01324531 16.58667327 0.07151065 -0.04949073 0.01075042 -0.05500117 Rb 4.10835739 20.77824483 0.03529892 0.06019531 -0.03051606 -0.06939625 Rb 4.12316661 16.56160427 4.20680878 0.08943927 0.00716268 0.07366643 Rb 0.00536431 20.78854820 4.19781199 -0.07213720 -0.03703462 0.04671004 Rb 8.24622554 16.51054527 0.01019182 0.01065156 0.00493572 -0.04078210 Rb 12.34343723 20.72868881 0.06233546 0.01860935 -0.03348895 -0.05159938 Rb 12.42612317 16.64343941 4.21698971 0.00245091 -0.01470415 0.06796251 Rb 8.21653470 20.72852156 4.11055217 0.02036380 -0.03385157 0.09887842 Rb 16.64730563 16.50953818 0.08039759 -0.02948125 0.01234816 -0.04549019 Rb 20.65401725 20.75202573 0.00219723 -0.01494402 -0.02136291 -0.05451495 Rb 20.64294262 16.49427656 4.06721973 -0.01373776 0.01097728 0.10233369 Rb 16.60037994 20.75348562 4.18286875 -0.00032598 -0.02973034 0.07849344 Rb 24.78112723 16.64028887 0.05069385 -0.05315128 -0.01002389 -0.07232970 Rb 29.02592908 20.74850873 0.04029053 0.04653802 -0.00973970 -0.06008827 Rb 28.94251314 16.69711802 4.07263049 0.06394996 -0.02096727 0.06545555 Rb 24.77375647 20.63652373 4.18330559 -0.06774805 -0.00503412 0.07647892 Rb 0.08230752 24.86942742 0.01636215 -0.07445861 -0.03549952 -0.07100848 Rb 4.06624133 29.05573769 0.00746571 0.04790648 0.05996375 -0.06117903 Rb 4.08130203 24.84508523 4.13784589 0.09332899 -0.05318296 0.07508578 Rb 0.05651733 28.92812050 4.17666777 -0.06859013 0.07400640 0.03570381 Rb 8.32267198 24.88132188 0.04462528 0.00050193 -0.04212501 -0.07092080 Rb 12.55877661 28.95196466 0.06963022 -0.01715088 0.06060897 -0.06125708 Rb 12.46322909 24.87067463 4.08187493 -0.00379068 -0.07859293 0.08435169 Rb 8.24952881 28.97842713 4.13091217 0.00560933 0.06777728 0.04871105 Rb 16.55134756 24.82037608 0.07567856 0.00585244 -0.05891170 -0.07585863 Rb 20.77393861 28.92783747 0.07451348 -0.01326135 0.05819470 -0.05937491 Rb 20.75697290 24.83191439 4.12386880 -0.03655498 -0.06908514 0.09523373 Rb 16.57454702 28.97372665 4.07195302 0.00844743 0.06660922 0.07826592 Rb 24.80611254 24.79387483 0.07566600 -0.03578307 -0.04910355 -0.08871383 Rb 29.03185355 28.91558432 0.05837655 0.03349251 0.03996166 -0.04329371 Rb 28.99231403 24.84089873 4.08231641 0.07959621 -0.06489433 0.07434997 Rb 24.89505248 28.91461896 4.17836055 -0.05246792 0.09107261 0.04255154 Rb 0.07821119 0.04552267 8.23168970 -0.06319767 -0.05419788 0.02455073 Rb 4.20909103 4.12494619 8.30212459 0.06399342 0.08709496 0.01540707 Rb 4.13149403 0.04208767 12.45794762 0.05557806 -0.06973934 -0.00343508 Rb 0.02688653 4.09032644 12.48720213 -0.07123326 0.07328009 -0.01712833 Rb 8.23399873 0.00409135 8.36901140 0.02616348 -0.05711955 -0.00093755 Rb 12.37068618 4.21037169 8.28368280 0.01163602 0.06496199 0.02356308 Rb 12.48494965 0.02134031 12.36092544 -0.01168825 -0.04907852 0.00723329 Rb 8.28867943 4.17285478 12.34377352 0.02048571 0.08593501 0.03165959 Rb 16.53091941 0.03703351 8.20463683 0.00337508 -0.04626071 0.01138275 Rb 20.74076122 4.15142683 8.23381780 -0.01086148 0.08577519 0.03454947 Rb 20.63242740 0.04997937 12.42945237 -0.00206338 -0.05040378 -0.00927689 Rb 16.52639991 4.08434664 12.44402319 0.00104332 0.10167484 0.00161151 Rb 24.92715093 0.08172680 8.20042499 -0.06819695 -0.07357458 0.03208087 Rb 29.02623337 4.06988583 8.29033872 0.06136015 0.07698464 0.01625851 Rb 28.91813031 0.01576393 12.47756708 0.05924698 -0.06574048 -0.01025379 Rb 24.88146644 4.09044428 12.49310131 -0.08671947 0.09922786 -0.02648011 Rb 0.03843635 8.26335561 8.23412608 -0.04740506 0.01998759 0.02257367 Rb 4.22413452 12.38479911 8.33660352 0.05904619 -0.00094366 0.00604030 Rb 4.11304398 8.27433773 12.47999159 0.08713718 0.02695011 0.00322966 Rb 0.04428409 12.49008438 12.42358442 -0.03995831 -0.01098224 0.01132998 Rb 8.29608940 8.35545465 8.31644111 0.01058450 0.01420963 0.02013731 Rb 12.39776900 12.50246860 8.28356859 0.02403707 -0.00767826 0.02403766 Rb 12.39000389 8.33467183 12.33991928 0.01415936 0.02223696 0.01923283 Rb 8.26863208 12.48006617 12.38906006 0.02818310 -0.01419114 0.03107963 Rb 16.59616188 8.20117845 8.32670622 -0.00478299 0.04188174 0.02826361 Rb 20.70027736 12.45969409 8.29854921 -0.02621501 -0.02135178 0.01898930 Rb 20.65520863 8.20347325 12.51102392 -0.01200880 0.02787600 -0.00840662 Rb 16.62128734 12.43604508 12.42212675 -0.00937548 0.00256418 0.00627574 Rb 24.91694651 8.39909801 8.28179949 -0.10776529 -0.02016615 0.01248795 Rb 29.01712483 12.45890979 8.22126680 0.05308299 0.02079522 0.00629568 Rb 28.96211561 8.40903784 12.34454518 0.04866243 -0.00609108 0.01799647 Rb 24.83218452 12.35819456 12.34745535 -0.09695056 0.01202531 0.02981111 Rb 0.05722383 16.51297229 8.34517121 -0.04868727 0.00272606 0.00654809 Rb 4.07270155 20.75122502 8.33909484 0.10753546 -0.02121347 0.00920575 Rb 4.22296409 16.59659201 12.42207461 0.06392440 -0.00929770 0.01420084 Rb 0.01186725 20.71980576 12.34168458 -0.05551066 -0.01843723 0.01261007 Rb 8.28484785 16.48602591 8.38492298 0.02495472 0.02995910 -0.01310459 Rb 12.48949606 20.78399771 8.21326472 -0.01853594 -0.04097002 0.03869971 Rb 12.42525879 16.57116495 12.43636771 0.00732699 -0.00259239 0.00599423 Rb 8.21372540 20.58720287 12.43094606 0.04626044 0.01101906 -0.00088225 Rb 16.58208294 16.50862641 8.26440253 -0.00652734 0.00843147 0.02617838 Rb 20.67291829 20.70665609 8.32342349 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28.99345351 12.32511121 -0.00426227 0.03779736 0.02296143 Rb 16.48540945 24.91772739 8.32530394 0.02262423 -0.08157051 0.00875202 Rb 20.69020122 29.06001051 8.29124278 -0.01412049 0.04396159 0.00806061 Rb 20.74572022 24.78887825 12.34167241 -0.03584530 -0.06429116 0.02637662 Rb 16.57846113 29.04247281 12.38196706 0.00288447 0.03749772 0.00937568 Rb 24.80830290 24.88071753 8.24706108 -0.06142717 -0.07766803 0.02027741 Rb 28.94510808 28.97939813 8.27995074 0.05262283 0.05029368 0.01728640 Rb 28.94811443 24.77701045 12.34374953 0.06124448 -0.04272548 0.00971456 Rb 24.80212803 29.01970381 12.51704320 -0.05440983 0.05202748 -0.00534396 Rb 0.01529213 0.03111134 16.50165406 -0.05473120 -0.05743848 0.01535724 Rb 4.07113595 4.15264920 16.55555945 0.10033660 0.08534920 0.01344997 Rb 4.10197187 0.04667292 20.74766016 0.05566490 -0.07150784 -0.02543507 Rb 0.00764276 4.14667038 20.77518697 -0.06587646 0.06042983 -0.02924938 Rb 8.21103771 0.02585763 16.53725446 0.02909236 -0.03971197 0.00442261 Rb 12.40136948 4.11371994 16.51867889 -0.01024005 0.10038561 0.00823331 Rb 12.48788602 0.04072431 20.68863095 -0.02581120 -0.05058037 -0.02188005 Rb 8.22614566 4.16696599 20.78265826 0.03149664 0.08271482 -0.03507987 Rb 16.52587904 0.02181949 16.56666102 0.00505944 -0.05388078 -0.00401377 Rb 20.72502681 4.09281458 16.61262608 -0.03703305 0.08654004 -0.00865190 Rb 20.65837165 0.02861719 20.76806318 0.00792192 -0.05772173 -0.01981160 Rb 16.56857925 4.07060286 20.66929633 -0.01457013 0.11973740 -0.02266601 Rb 24.88118492 0.05393708 16.54055277 -0.06795114 -0.07952813 0.01779244 Rb 28.98989838 4.10417061 16.46075565 0.07744829 0.07229585 0.00899840 Rb 29.02038774 0.03689157 20.76836192 0.04908421 -0.05214063 -0.02183120 Rb 24.89362490 4.19487791 20.61137506 -0.07376473 0.04334082 -0.00015788 Rb 0.07239050 8.32583782 16.64322125 -0.05098860 0.01668471 -0.01061525 Rb 4.18369218 12.51233062 16.63161924 0.07686583 -0.00409858 -0.02085764 Rb 4.20901701 8.41189970 20.74261854 0.07959843 -0.02004376 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28.92822929 16.62473062 20.63072217 0.04597800 -0.01849292 -0.00441413 Rb 24.89975925 20.73757902 20.78306536 -0.10101544 -0.03224761 -0.05033370 Rb 0.02213217 24.84500541 16.51467365 -0.07986754 -0.06048927 0.01002679 Rb 4.08912032 28.91249758 16.63668020 0.07258521 0.07352547 -0.01189643 Rb 4.14899442 24.77046914 20.66787173 0.08174647 -0.05699786 -0.00310394 Rb 0.02257512 28.97098428 20.72104714 -0.05378855 0.04752065 -0.00721172 Rb 8.24699710 24.80326638 16.55116523 0.03537888 -0.06884186 -0.00294791 Rb 12.42252868 29.05125859 16.45897565 -0.00018625 0.03671021 0.01684012 Rb 12.42983683 24.92507125 20.73520065 -0.00762012 -0.08132010 -0.03113603 Rb 8.27760792 29.06440479 20.73610310 0.01440108 0.04104395 -0.03173348 Rb 16.49050182 24.77544541 16.59533257 0.01566911 -0.06408431 -0.01697192 Rb 20.63645584 28.95165588 16.62081769 -0.01655306 0.03501521 -0.02617476 Rb 20.70271401 24.91537087 20.72650391 -0.02765839 -0.11156745 -0.02167760 Rb 16.62290913 28.98578608 20.72230401 -0.02179997 0.05049610 -0.00779406 Rb 24.89500943 24.78702965 16.63126181 -0.08793019 -0.07540161 -0.01940627 Rb 28.95552343 28.95542590 16.52139342 0.05526049 0.04786885 -0.00282726 Rb 28.97677849 24.85428755 20.64709516 0.07169461 -0.03835417 -0.00205126 Rb 24.77645178 29.03563143 20.62578345 -0.03138605 0.06387658 0.00581339 Rb 0.00289155 0.05648794 24.86735189 -0.06687408 -0.07566395 -0.02988335 Rb 4.06618485 4.08209433 24.87262876 0.09015666 0.08486435 -0.07016609 Rb 4.19118481 0.03229457 29.05514581 0.03089723 -0.06656272 0.06026322 Rb 0.03488344 4.13313422 28.96352174 -0.06958244 0.03463243 0.07310955 Rb 8.26441218 0.00303005 24.83538730 0.01131335 -0.06603782 -0.05916598 Rb 12.45968897 4.08415542 24.85128087 -0.00925466 0.09584485 -0.08719019 Rb 12.28742216 0.05677925 28.92575614 0.01116077 -0.05778754 0.05777651 Rb 8.21904368 4.17863285 28.98630122 0.02036157 0.05669552 0.06137189 Rb 16.51206767 0.06209086 24.79209928 0.01276341 -0.07058347 -0.02695799 Rb 20.72022282 4.17624082 24.80124110 -0.01948912 0.04888152 -0.05540358 Rb 20.74804058 0.00208923 29.01609578 -0.02121483 -0.04371876 0.03928361 Rb 16.48398398 4.12669426 29.02115404 0.01759161 0.04910105 0.06524275 Rb 24.93157099 0.03723140 24.89095349 -0.06261742 -0.08312544 -0.06120935 Rb 28.95367289 4.14604455 24.79982267 0.09056173 0.05293213 -0.03260506 Rb 28.98872330 0.05266022 29.06784144 0.04219954 -0.03568391 0.03633735 Rb 24.88457056 4.10377653 28.92613111 -0.05249201 0.05565571 0.08858159 Rb 0.05581750 8.25497200 24.88124106 -0.07502271 0.01217883 -0.05800370 Rb 4.09642764 12.38521174 24.79822851 0.10382441 0.01760822 -0.04284349 Rb 4.12208984 8.25682822 28.96395908 0.07027672 0.02476025 0.06556437 Rb 0.06251101 12.35191546 28.98416311 -0.05276064 0.00948921 0.05131100 Rb 8.38354749 8.31509560 24.90751282 -0.00941028 0.00610054 -0.07989876 Rb 12.40640464 12.36145922 24.92293518 0.01821299 0.02335220 -0.09261921 Rb 12.42366714 8.28116846 28.92721524 0.01040093 0.01481824 0.06111146 Rb 8.36386049 12.49834032 29.02323252 -0.01716247 -0.00883569 0.04407660 Rb 16.62789592 8.21618702 24.90786275 -0.01740109 0.03272784 -0.10001193 Rb 20.62976312 12.46670252 24.78031001 0.00521821 -0.01147821 -0.08478171 Rb 20.78969187 8.28995846 28.92753828 -0.02426053 0.01492347 0.05670919 Rb 16.62945580 12.50654172 28.96402694 -0.01120315 -0.01793671 0.05321338 Rb 24.86990854 8.20685099 24.85650830 -0.06405472 0.04672354 -0.07071020 Rb 29.02295923 12.49936163 24.90018590 0.06127839 -0.01636872 -0.07381477 Rb 28.95224892 8.35142786 29.04582273 0.05003220 0.00186687 0.04578329 Rb 24.85621498 12.47651752 28.97391729 -0.05935075 -0.01275530 0.05865769 Rb 0.06445163 16.60402158 24.91398841 -0.07561190 -0.01744835 -0.06302817 Rb 4.10058427 20.72116212 24.85155276 0.08953365 -0.01342835 -0.07055727 Rb 4.09175419 16.60069557 29.00980400 0.06816249 -0.01676242 0.06269829 Rb 0.01297775 20.66251351 28.94230556 -0.05782816 0.00382404 0.06075227 Rb 8.28738457 16.62078728 24.87327511 0.01416939 -0.02384536 -0.08875932 Rb 12.43060215 20.75645868 24.81314495 0.01403067 -0.02900426 -0.07282594 Rb 12.36096602 16.52827018 29.04302968 0.01561286 0.01089711 0.03612561 Rb 8.27143217 20.69177040 28.91838889 0.01197603 -0.00239992 0.05514362 Rb 16.56857894 16.49803381 24.88532518 -0.01406254 0.02924671 -0.08614984 Rb 20.75771264 20.68060271 24.86113589 -0.05638831 -0.01309068 -0.08283932 Rb 20.76494744 16.50180258 28.93423296 -0.02411117 0.01546207 0.05461305 Rb 16.49104199 20.68277499 29.07214636 0.01959239 -0.02081220 0.03391486 Rb 24.90799926 16.57131554 24.93047309 -0.08470858 -0.01273718 -0.09871343 Rb 28.90761274 20.72049919 24.78760029 0.08385278 -0.01127437 -0.03539808 Rb 28.98155365 16.55503387 28.91988820 0.05784582 0.01403751 0.06317004 Rb 24.80074073 20.73665761 28.98576268 -0.04005078 -0.01402140 0.07548280 Rb 0.06223959 24.89863258 24.89261964 -0.08845119 -0.04419581 -0.05309999 Rb 4.16868109 29.01356018 24.85468331 0.04220287 0.08214395 -0.05144595 Rb 4.07475690 24.92995689 28.92549463 0.05755337 -0.06118457 0.09052777 Rb 0.00582708 29.05854357 29.06686847 -0.03507648 0.03677759 0.03127519 Rb 8.28034833 24.88979513 24.87544168 0.00914448 -0.09124330 -0.08350497 Rb 12.31109962 28.91592435 24.88659186 0.02539375 0.07510608 -0.05937529 Rb 12.47848965 24.81515734 29.03738501 -0.01227767 -0.05902044 0.06674477 Rb 8.33288940 28.91465008 28.98334464 0.00287862 0.05601292 0.06529104 Rb 16.53559114 24.90517548 24.93060414 0.00914003 -0.09491176 -0.09094375 Rb 20.77513426 28.94497496 24.91243347 -0.02111269 0.07592542 -0.06105020 Rb 20.79013327 24.90876175 28.91037570 -0.03182337 -0.07067770 0.07460353 Rb 16.52223348 28.94021377 29.01978699 0.00219223 0.05807558 0.04903583 Rb 24.88223735 24.78499928 24.81225213 -0.05298713 -0.03594429 -0.06236013 Rb 29.06010882 29.03757677 24.92452886 0.04640310 0.04829277 -0.05019464 Rb 29.06621053 24.85605374 29.04714804 0.05267177 -0.04226474 0.05134548 Rb 24.86382594 28.95698255 28.97611535 -0.02531355 0.06217267 0.06299856