500 Lattice="31.518113005867853 0.0 0.0 0.0 31.518113005867853 0.0 0.0 0.0 31.518113005867853" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-586.4962576165038 pbc="F F F" Sr -0.05793345 0.05681387 -0.02441809 38 -0.07424805 -0.09000981 -0.06757259 Sr 3.17160115 3.11688121 -0.03720905 38 0.13464460 0.15037741 -0.16606332 Sr 3.18916608 -0.03277760 3.15886235 38 0.08578105 -0.21081457 0.09314821 Sr -0.00612017 3.12992858 3.19412847 38 -0.18739568 0.17910030 0.06872337 Sr 6.37214525 0.01298212 -0.02010351 38 -0.00159609 -0.16043908 -0.11972244 Sr 9.40108718 3.18724050 0.05358634 38 0.10487719 0.07358697 -0.14111223 Sr 9.51484989 -0.05545219 3.18225543 38 -0.02757179 -0.13873164 0.07882070 Sr 6.25898216 3.12851343 3.18623759 38 0.10369803 0.20345119 0.17308190 Sr 12.64004565 -0.03809996 0.01442492 38 -0.07232695 -0.11019953 -0.17509934 Sr 15.74997498 3.12793860 0.05332283 38 0.07288991 0.15412032 -0.24489859 Sr 15.73765431 -0.05178538 3.09588403 38 0.07616840 -0.17699752 0.21835844 Sr 12.66406172 3.13030071 3.16262388 38 -0.11469345 0.24356906 0.18851272 Sr 19.00242401 0.00058240 0.01967454 38 -0.03539603 -0.14287332 -0.16152768 Sr 22.11718185 3.18325864 -0.00735528 38 -0.09465347 0.13653919 -0.22629663 Sr 22.08901850 0.06179127 3.15094273 38 -0.01747657 -0.23788733 0.14148036 Sr 18.94713678 3.15540051 3.09941311 38 -0.08622152 0.17899776 0.23827026 Sr 25.24278783 -0.04465054 0.05241883 38 -0.10567774 -0.16634591 -0.21258194 Sr 28.40906601 3.17239223 0.05833383 38 0.17503029 0.08218980 -0.17928106 Sr 28.30847749 0.03606699 3.20577943 38 0.21818479 -0.21117167 0.08098002 Sr 25.18700922 3.13820507 3.09595505 38 -0.15576109 0.20288679 0.31916583 Sr 0.02871159 6.24293895 0.01908868 38 -0.11981116 0.04388542 -0.11465673 Sr 3.15515174 9.47709923 0.02793499 38 0.18764366 -0.09857784 -0.16204542 Sr 3.21211152 6.31266356 3.20059077 38 0.12443648 0.04956928 0.10769609 Sr -0.05222241 9.45704979 3.17274061 38 -0.15262085 -0.07276749 0.10793987 Sr 6.36352849 6.27638515 0.04731754 38 -0.07356449 0.09508075 -0.16334053 Sr 9.46332271 9.50734026 -0.01656741 38 0.05773431 -0.05776385 -0.10941613 Sr 9.43199238 6.37125795 3.16537349 38 0.08264128 -0.08802131 0.22738881 Sr 6.38124284 9.49211250 3.19241108 38 -0.07033472 -0.04190249 0.15781152 Sr 12.61896347 6.24813167 0.04788069 38 -0.03969458 0.09117993 -0.13834528 Sr 15.77450353 9.40084500 0.05794071 38 -0.06469343 0.04802099 -0.19730427 Sr 15.81248641 6.28803017 3.12866343 38 -0.07027461 0.00844374 0.28649776 Sr 12.63821431 9.49359940 3.19587312 38 -0.05969282 -0.05903879 0.10239324 Sr 18.92039534 6.39441260 0.05822437 38 0.03961406 -0.08949361 -0.19444541 Sr 22.06804252 9.44403798 -0.04482565 38 0.03880118 0.00262024 -0.08777969 Sr 22.05219887 6.30952500 3.20870078 38 -0.01134505 0.04390779 0.11436696 Sr 18.86168761 9.46957000 3.19622629 38 0.11107644 0.05311189 0.17651044 Sr 25.19934758 6.23324794 0.03357482 38 -0.14776324 0.09597125 -0.23211075 Sr 28.35068977 9.39304801 -0.02163095 38 0.14010442 0.03458621 -0.17508634 Sr 28.30979205 6.35885456 3.14222621 38 0.27121118 -0.04927965 0.17295327 Sr 25.26166718 9.41005955 3.13401201 38 -0.25736367 0.08924266 0.18445506 Sr 0.02421788 12.52709525 -0.00991827 38 -0.17841478 0.05636130 -0.12742005 Sr 3.14256924 15.69845597 -0.02177577 38 0.16111008 0.01962904 -0.17822713 Sr 3.21145616 12.60044892 3.09817918 38 0.15736791 0.03689174 0.29799329 Sr 0.02339393 15.79940155 3.14709994 38 -0.14526308 -0.06513171 0.08737608 Sr 6.35615748 12.56709783 -0.04977080 38 -0.00645652 0.05179093 -0.13210687 Sr 9.45083117 15.77329285 -0.00003279 38 0.03481526 -0.03195173 -0.16654915 Sr 9.43124505 12.68009836 3.18703623 38 0.09065058 -0.02584834 0.15835187 Sr 6.33939677 15.78903309 3.13586621 38 -0.06016458 -0.07859293 0.23301209 Sr 12.62208631 12.58391868 -0.01363755 38 -0.03233042 0.00888089 -0.13705109 Sr 15.74309971 15.72350303 -0.01163919 38 0.02814551 0.00894264 -0.13624627 Sr 15.71204024 12.57131055 3.14017922 38 0.13185989 0.08972160 0.21339759 Sr 12.65554846 15.72742572 3.17000719 38 -0.07002741 0.06687751 0.20496110 Sr 18.92047132 12.54572096 -0.05885452 38 -0.02807173 0.03747720 -0.07560590 Sr 21.98583521 15.78001890 -0.04700018 38 0.03131053 -0.00597055 -0.09068321 Sr 22.07684518 12.57292300 3.14430868 38 -0.07793729 0.05019024 0.14932447 Sr 18.85648850 15.79331873 3.14386006 38 0.08169718 -0.12529557 0.21107224 Sr 25.25885549 12.64527259 0.05836227 38 -0.24186679 -0.05327031 -0.22499651 Sr 28.31613813 15.75811386 -0.00485709 38 0.22189981 0.01456103 -0.19190851 Sr 28.36179727 12.64162884 3.09074166 38 0.19690995 -0.04304642 0.25419610 Sr 25.19058648 15.83833236 3.09146756 38 -0.24139530 -0.05926281 0.28442150 Sr 0.03567060 18.91685362 -0.06201820 38 -0.15853755 -0.02887853 -0.12486000 Sr 3.09790763 22.03832907 0.02064307 38 0.21478635 0.08022209 -0.21344859 Sr 3.20417087 18.94223845 3.09321368 38 0.12062663 -0.07411676 0.27678088 Sr 0.01505909 22.06537982 3.14592323 38 -0.24046859 -0.03774229 0.13965486 Sr 6.26057003 18.89199678 0.01794661 38 0.06132528 0.04927421 -0.21873374 Sr 9.51395849 22.07161205 -0.01798029 38 -0.08044637 -0.06718339 -0.15245005 Sr 9.41086233 18.87662201 3.10900128 38 0.13658612 0.06842410 0.27950116 Sr 6.32320530 22.04071060 3.19029957 38 0.06656281 0.02035645 0.09528641 Sr 12.62528706 18.88220076 -0.01662490 38 0.03909931 0.02423764 -0.08409890 Sr 15.80072101 22.09391082 -0.05930704 38 -0.07182317 -0.05067719 -0.11180025 Sr 15.81630587 18.90213934 3.20817939 38 -0.14238319 0.04934784 0.09006315 Sr 12.62027462 22.08842993 3.12935666 38 0.06028163 -0.11411664 0.24984588 Sr 18.86849602 18.90674520 -0.01246115 38 0.00908983 0.02025188 -0.14554654 Sr 22.07142457 22.02396509 0.05050592 38 -0.02261439 0.01195098 -0.15248290 Sr 22.00234945 18.94583662 3.20285993 38 0.02109472 -0.11434452 0.10605277 Sr 18.86204090 22.01443544 3.20134842 38 0.03909554 0.06173388 0.12147836 Sr 25.27225879 18.89433696 0.03729160 38 -0.29165403 0.02442948 -0.25958941 Sr 28.30840047 22.06146345 0.05671736 38 0.17339876 0.03636219 -0.19110180 Sr 28.32059826 18.92371387 3.10578127 38 0.25315288 -0.03181394 0.28437680 Sr 25.19906746 22.00012397 3.19064194 38 -0.18424922 0.04588074 0.17691165 Sr -0.03925365 25.27220979 -0.03743480 38 -0.14344570 -0.12573664 -0.12562237 Sr 3.15298059 28.34537007 -0.02149118 38 0.06621185 0.15285870 -0.12944556 Sr 3.10087194 25.15368871 3.21369545 38 0.27453102 -0.09606468 0.02568360 Sr 0.01470258 28.32282789 3.25688162 38 -0.19331139 0.19891302 -0.00728623 Sr 6.29693376 25.22931085 -0.01472903 38 0.00147560 -0.20285217 -0.13187172 Sr 9.48206560 28.35578455 -0.05285496 38 -0.06506476 0.15105545 -0.12510397 Sr 9.44725967 25.15647304 3.14032710 38 -0.05067547 -0.11837630 0.18720824 Sr 6.25551468 28.40403139 3.12179759 38 0.06513293 0.14029924 0.14499578 Sr 12.55521023 25.26168008 0.05133596 38 0.08395552 -0.17719474 -0.20702346 Sr 15.78467402 28.31135776 -0.00479766 38 -0.06316978 0.18476905 -0.16505777 Sr 15.82007722 25.22574904 3.09372617 38 -0.10279648 -0.20134353 0.32992024 Sr 12.51356185 28.42434793 3.14983140 38 0.08372739 0.15538646 0.14646119 Sr 18.91139156 25.22088501 0.00893008 38 0.09938022 -0.17156520 -0.18794581 Sr 22.13466064 28.35504602 -0.06059201 38 -0.06179949 0.14060498 -0.09470923 Sr 22.03219568 25.19582877 3.18863005 38 -0.01057349 -0.14673863 0.14633960 Sr 18.89319479 28.42602344 3.10761108 38 0.08278823 0.16952973 0.20107039 Sr 25.22237522 25.27156681 0.02139065 38 -0.17247916 -0.26078289 -0.20375943 Sr 28.30518419 28.35830742 0.05219353 38 0.15498503 0.12321049 -0.12033899 Sr 28.32720043 25.18456162 3.19858652 38 0.25539233 -0.11957989 0.13633412 Sr 25.25121253 28.33857249 3.17478937 38 -0.19622131 0.25620196 0.18305828 Sr 0.00078494 0.04721005 6.27654169 38 -0.16519573 -0.21131198 0.01097941 Sr 3.09574315 3.19517529 6.29324126 38 0.29313478 0.12880857 0.03744329 Sr 3.14534394 0.01986162 9.39514173 38 0.16344661 -0.20565384 0.01401330 Sr -0.01725272 3.11399989 9.41652452 38 -0.22160673 0.15020641 0.06885760 Sr 6.36643143 0.04532777 6.24887597 38 -0.04940335 -0.16983002 0.09948826 Sr 9.49754423 3.10795386 6.33850447 38 0.01289926 0.34484718 -0.05362779 Sr 9.51693611 -0.00916399 9.39738337 38 -0.06787055 -0.16442340 0.05791092 Sr 6.29109997 3.19753265 9.41510780 38 0.05555301 0.10531394 0.00187547 Sr 12.60769535 0.04485546 6.28475151 38 0.05452920 -0.20122004 0.05110345 Sr 15.70590430 3.12662475 6.32703087 38 0.11791031 0.22759382 -0.02913413 Sr 15.75948565 0.01247376 9.42537923 38 0.03101189 -0.19160056 -0.01616203 Sr 12.58890807 3.17770421 9.52650976 38 -0.05300923 0.22838333 -0.07588539 Sr 18.94196669 -0.02548034 6.24525016 38 -0.07687239 -0.12567283 0.03218457 Sr 21.97212841 3.15220651 6.27941493 38 0.08213674 0.21662477 0.08013727 Sr 21.96454606 0.04865887 9.49224320 38 0.05046905 -0.19752053 -0.05627902 Sr 18.86275998 3.12994455 9.50718115 38 -0.01698828 0.27301760 -0.06537872 Sr 25.19423413 -0.06258599 6.29064583 38 -0.20306929 -0.13206353 0.05688209 Sr 28.38240956 3.14449754 6.26663388 38 0.15522712 0.18927736 0.05970243 Sr 28.36616589 -0.02186905 9.38157224 38 0.15071207 -0.14038217 -0.00128724 Sr 25.16509487 3.11342891 9.41659766 38 -0.13347473 0.26701453 -0.02257464 Sr 0.02742264 6.28245423 6.36761487 38 -0.19913099 0.05470177 -0.04375089 Sr 3.09253066 9.45647610 6.28181834 38 0.32577945 0.01954662 0.04769571 Sr 3.15512909 6.27286422 9.48130264 38 0.21980984 0.10093233 -0.05196916 Sr 0.06233981 9.44691681 9.45124708 38 -0.17747336 0.00537342 0.03539386 Sr 6.34418379 6.26530226 6.31236566 38 -0.01004348 0.08209347 0.00466674 Sr 9.50871311 9.46273409 6.26551310 38 0.00168879 0.02361502 0.09774045 Sr 9.44073410 6.34935520 9.43134157 38 0.07260441 -0.03707230 0.01516369 Sr 6.33742698 9.41301295 9.39860706 38 -0.09794707 0.05919166 0.05286190 Sr 12.64902948 6.34348328 6.26575995 38 -0.03366347 -0.02236575 0.07399157 Sr 15.79127121 9.47863590 6.28554525 38 -0.04490636 -0.04004020 0.10779202 Sr 15.70307931 6.24135497 9.47967699 38 0.05884048 0.12342541 -0.02452082 Sr 12.57597974 9.49860987 9.47635160 38 0.03442701 -0.08255319 -0.06588493 Sr 18.89290703 6.31233601 6.26652936 38 -0.04070451 -0.01483830 0.12576843 Sr 22.12397384 9.41261843 6.25759071 38 -0.07911107 0.04513142 0.14576593 Sr 22.00838857 6.26217757 9.47365845 38 0.06840158 0.10702257 -0.06582764 Sr 18.85200931 9.47320686 9.41715248 38 0.09105103 -0.03206400 0.02033111 Sr 25.26433439 6.28602352 6.25760715 38 -0.28607987 -0.02094734 0.14657414 Sr 28.35310379 9.44674236 6.36121585 38 0.16296467 0.06371424 -0.07896014 Sr 28.37206932 6.35039574 9.47772049 38 0.12711055 -0.08522281 -0.05285256 Sr 25.26346188 9.51587402 9.44894919 38 -0.35825742 -0.09968629 -0.02872353 Sr -0.04498198 12.58286834 6.23443765 38 -0.08920744 0.06502133 0.06382299 Sr 3.18162439 15.78722372 6.33643560 38 0.22125346 -0.08181969 -0.03888195 Sr 3.13218079 12.62032714 9.49491266 38 0.27616290 -0.10121180 -0.09280730 Sr 0.01653396 15.70532950 9.47093069 38 -0.17010364 0.05663145 -0.01092616 Sr 6.35842658 12.56411489 6.28499545 38 -0.07918720 0.07007205 0.09614950 Sr 9.42964115 15.78945115 6.37613531 38 0.06065228 -0.07228959 -0.04395467 Sr 9.41892282 12.57725077 9.50600223 38 0.05963767 0.03402464 -0.08969511 Sr 6.30037549 15.70337802 9.50988385 38 0.03324605 0.08490794 -0.08494788 Sr 12.66281586 12.59905658 6.28033788 38 -0.08662438 0.06449399 0.12896023 Sr 15.76355941 15.81649413 6.33402306 38 0.02162838 -0.12680800 0.00220107 Sr 15.72088636 12.56797914 9.50759643 38 0.07127699 0.07125091 -0.07327642 Sr 12.65184839 15.81668780 9.41069242 38 -0.04416302 -0.13992899 0.04200281 Sr 18.95092055 12.63793659 6.29930468 38 -0.04822202 -0.02310006 0.00386247 Sr 22.11393536 15.73742016 6.32192410 38 -0.12191694 0.03319029 -0.03224819 Sr 22.05195967 12.60413269 9.49292338 38 0.02132723 -0.07019552 -0.07137418 Sr 18.92657335 15.74057094 9.36851302 38 -0.05781792 0.07729496 0.09500690 Sr 25.16648653 12.65591655 6.24250070 38 -0.13543975 -0.08032616 0.01870601 Sr 28.32594595 15.75861587 6.34164365 38 0.18724067 -0.00520688 -0.09344369 Sr 28.30970616 12.57883040 9.44214814 38 0.20611196 0.03727778 0.01013448 Sr 25.26906168 15.71844671 9.41394451 38 -0.31322626 0.00057469 0.14252940 Sr -0.00452180 18.86105597 6.22344199 38 -0.12626724 0.08003236 0.09458328 Sr 3.20755121 22.09578695 6.24620845 38 0.11104389 -0.08674379 0.12353529 Sr 3.09159401 18.95170792 9.40540964 38 0.27616067 -0.06670309 0.01855251 Sr 0.03514396 22.08897155 9.46092857 38 -0.18629899 -0.06028634 -0.05626762 Sr 6.33050826 18.91484859 6.27352346 38 0.00246498 -0.02674813 0.10438926 Sr 9.47818227 22.08513480 6.37141068 38 -0.02438208 -0.09614909 -0.06257753 Sr 9.50825713 18.86706890 9.40985278 38 -0.13277301 0.06028714 0.08405475 Sr 6.24753884 22.00783244 9.43508655 38 0.08959572 0.01068193 0.04257569 Sr 12.63479659 18.92408885 6.28645942 38 -0.06427476 0.00963876 -0.08380162 Sr 15.81118605 22.04543685 6.38052836 38 -0.09601751 0.05301653 -0.08840646 Sr 15.73247341 18.92861500 9.42667548 38 0.14556759 -0.06820351 0.09301762 Sr 12.62500802 22.00062823 9.40656858 38 -0.03400301 0.09809208 0.03800890 Sr 18.91291782 18.93689879 6.27167642 38 0.05364415 -0.08093684 0.14628756 Sr 22.12550489 22.00195600 6.26976052 38 -0.09735754 0.08176888 0.07137268 Sr 22.12410102 18.93831388 9.42465333 38 -0.13088848 -0.07104283 0.07554351 Sr 18.97139802 22.05069129 9.39296071 38 0.00544684 -0.04004561 0.13183436 Sr 25.16763196 18.85797828 6.35788724 38 -0.07283594 0.06376663 -0.03233685 Sr 28.37662238 22.05638098 6.34074807 38 0.10231913 -0.07137961 0.03482602 Sr 28.38440440 18.85516689 9.47734469 38 0.10037477 0.08000819 -0.02976155 Sr 25.15715636 22.10381037 9.47776846 38 -0.07210460 -0.07266002 -0.00989952 Sr 0.00336214 25.22078797 6.30851841 38 -0.23123629 -0.19967337 0.07669518 Sr 3.11166303 28.34899171 6.27737802 38 0.23754044 0.18968653 0.10710852 Sr 3.09189813 25.23246181 9.50083276 38 0.34372810 -0.23823275 -0.08764570 Sr 0.03718913 28.33092150 9.52162751 38 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