864 Lattice="37.64987754821777 0.0 0.0 0.0 37.64987754821777 0.0 0.0 0.0 37.64987754821777" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1067.5760609599297 stress="-0.00026159059802670034 4.928042417396689e-08 9.757416758642987e-06 4.928042417396689e-08 -0.0002668449577511596 1.2271765479884284e-05 9.757416758642987e-06 1.2271765479884284e-05 -0.00025797672220489846" pbc="F F F" Sr 0.00254960 0.01773138 0.01281218 -0.10152503 -0.12116770 -0.11116513 Sr 3.16128711 3.11528422 0.01868960 0.11664137 0.21547237 -0.25830680 Sr 3.14088514 0.03560073 3.17605191 0.11261034 -0.29200309 0.10538976 Sr 0.02303101 3.12770945 3.12115600 -0.24525396 0.21392759 0.19601104 Sr 6.19161147 0.04921606 0.02799551 0.07247679 -0.20697047 -0.16278831 Sr 9.40995941 3.07762541 0.03683980 -0.08763842 0.23866476 -0.23343313 Sr 9.42424706 0.00241961 3.11071810 -0.06710029 -0.21852730 0.20574758 Sr 6.21402988 3.18971234 3.16959043 0.13800643 0.19421891 0.15230714 Sr 12.51963973 0.05284183 0.00629659 0.03797202 -0.20884640 -0.20524218 Sr 15.71653390 3.09209886 0.03955563 -0.04394669 0.21664341 -0.28741257 Sr 15.64721610 0.02418463 3.11031522 0.04276277 -0.25578720 0.21745528 Sr 12.51575328 3.12926133 3.13523176 0.03039008 0.22651129 0.22507850 Sr 18.78162088 0.02230630 0.05895875 0.04595481 -0.21154885 -0.19468723 Sr 21.95255806 3.10584689 0.01158501 -0.02823157 0.16262177 -0.21054116 Sr 21.96266092 0.02356932 3.12336841 -0.05410717 -0.23170406 0.21117979 Sr 18.77165841 3.14596221 3.13847498 0.11997849 0.14134228 0.26624738 Sr 25.06999867 0.03535845 0.00579000 0.05261204 -0.19637928 -0.16787624 Sr 28.17952418 3.18889813 0.01958922 0.03843846 0.13536162 -0.19083275 Sr 28.26435350 0.04809800 3.16834171 -0.05679566 -0.24366335 0.05683248 Sr 25.04276992 3.09447013 3.15680832 0.05585428 0.30862920 0.25086681 Sr 31.43196639 0.02766454 0.01653000 -0.16110687 -0.20246123 -0.20768377 Sr 34.51286715 3.15089781 0.02110290 0.22604355 0.10882205 -0.18640480 Sr 34.52902198 0.02167980 3.18350129 0.22034863 -0.22885795 0.05525823 Sr 31.36274015 3.08380558 3.10867753 -0.21295117 0.30121783 0.18891036 Sr 0.02453871 6.21313310 0.04086163 -0.15078550 0.06516826 -0.17938944 Sr 3.17813768 9.40289589 0.02282443 0.05204192 0.00600131 -0.23759171 Sr 3.16543810 6.32121740 3.17145279 0.16268333 -0.04748623 0.17648475 Sr 0.04046403 9.35522075 3.19233137 -0.25151138 0.04730827 0.04840459 Sr 6.27723284 6.33358489 0.03198995 0.07774116 -0.04658243 -0.18003551 Sr 9.45832712 9.46228524 0.05117553 -0.11442849 -0.05918976 -0.19505293 Sr 9.45794048 6.25810319 3.13471212 -0.09862580 0.10130144 0.25032331 Sr 6.23445978 9.45290163 3.12785969 0.21033118 -0.06911242 0.24445496 Sr 12.55301515 6.22456531 0.05619323 0.03395222 0.08977912 -0.20885905 Sr 15.74601673 9.47228396 0.03676180 -0.04380263 -0.11307334 -0.13715628 Sr 15.73099698 6.21336679 3.08816398 -0.06369918 0.19123516 0.27053210 Sr 12.51708822 9.47467910 3.13169402 0.08467718 -0.13060072 0.26901764 Sr 18.91303839 6.23572044 0.02549288 -0.07480958 0.06317244 -0.21590614 Sr 21.92265238 9.44903755 0.00316468 0.02725995 -0.08329391 -0.20839628 Sr 21.91472918 6.28537278 3.18742136 0.05222891 -0.06396874 0.17649801 Sr 18.86651558 9.35651569 3.19195616 -0.11407639 0.07272595 0.21249335 Sr 25.01923309 6.23307609 0.06027978 -0.00673432 0.05876996 -0.18011705 Sr 28.18382552 9.35433901 0.01763295 0.03840904 0.04690792 -0.13464168 Sr 28.19591871 6.33435722 3.18033597 0.01786334 -0.08905811 0.19355375 Sr 25.01385630 9.38231563 3.13352659 0.10741629 0.04413369 0.20591911 Sr 31.42716877 6.28399056 0.04472821 -0.23177511 0.00873804 -0.22078146 Sr 34.49670227 9.44554399 0.01656119 0.19180951 -0.02725424 -0.16486063 Sr 34.45376217 6.26111616 3.17807504 0.30364686 0.03615481 0.10488706 Sr 31.41484868 9.38239192 3.17787760 -0.27623193 0.05963537 0.14336751 Sr 0.04155061 12.56081962 0.01437932 -0.17251557 -0.05997262 -0.12377741 Sr 3.10028308 15.64875544 0.04880102 0.21027785 0.07181829 -0.20951673 Sr 3.17032312 12.50275285 3.18630181 0.07523019 0.08781000 0.15608578 Sr 0.00840642 15.68861356 3.16356154 -0.18633493 -0.08536296 0.16806104 Sr 6.19123077 12.60397155 0.01481711 0.08736913 -0.08344385 -0.21273694 Sr 9.35983820 15.63136398 0.02960774 0.05388981 0.02849137 -0.25547080 Sr 9.43357744 12.62459445 3.08402943 -0.03505544 -0.07613338 0.39665563 Sr 6.31352080 15.64077538 3.13593761 -0.08243607 0.09316519 0.28723117 Sr 12.51350859 12.48870852 0.05799281 0.06863394 0.09410082 -0.26858044 Sr 15.64762884 15.64342432 0.04459717 0.07179483 0.00731253 -0.24336382 Sr 15.62941372 12.58856943 3.16040711 0.10160197 -0.10972933 0.19432409 Sr 12.60733603 15.68730473 3.11193532 -0.09240994 0.01457775 0.34406425 Sr 18.83120992 12.49174033 0.01676688 -0.03461098 0.09308024 -0.12212189 Sr 21.90842505 15.67059421 0.05364993 0.04857501 0.03863406 -0.16972757 Sr 21.96813220 12.49062188 3.10863349 -0.05723685 0.13829319 0.33366745 Sr 18.78273982 15.72241594 3.15459225 0.10008859 -0.03120743 0.20034968 Sr 25.08531574 12.49380984 0.04621156 0.02966141 0.01798229 -0.21130217 Sr 28.14375361 15.69157009 0.05778611 0.07613402 -0.05685662 -0.24916057 Sr 28.25852367 12.57389039 3.19366065 -0.03503901 -0.07548433 0.13388544 Sr 25.12171755 15.63035714 3.08192241 -0.09939317 0.06422664 0.37079375 Sr 31.39722376 12.54847756 0.05043729 -0.23153912 -0.01904089 -0.20836347 Sr 34.52691479 15.65617997 0.01134528 0.16589163 0.00483488 -0.13689208 Sr 34.54739964 12.50316778 3.18703486 0.18152360 0.07660794 0.12973645 Sr 31.34858251 15.67457387 3.10658861 -0.14965030 0.00869606 0.29309089 Sr 0.00416181 18.78159989 0.03437274 -0.18357413 0.03724395 -0.16879184 Sr 3.10492415 21.95946276 0.04279411 0.20268501 0.00359714 -0.27777052 Sr 3.15154889 18.82964359 3.09251128 0.21250260 -0.08228169 0.27476204 Sr 0.01805675 22.00009479 3.16195550 -0.25464849 -0.05611052 0.15272574 Sr 6.32413603 18.85136576 0.00816651 -0.09405160 -0.11945069 -0.22379432 Sr 9.34986727 21.90082849 0.00229550 0.14402666 0.11234045 -0.15089657 Sr 9.40231276 18.76675851 3.09407272 0.01941503 0.04640077 0.32406485 Sr 6.24610418 21.90424413 3.08127817 0.07711110 0.16454412 0.34238103 Sr 12.49792488 18.74058766 0.04301481 0.01032580 0.03472504 -0.22943552 Sr 15.63858243 21.86299407 0.02815710 0.00128472 0.09533697 -0.25340864 Sr 15.74191940 18.84248484 3.09053186 -0.05293803 -0.08997988 0.36481830 Sr 12.59699795 21.87103238 3.14725841 -0.14534937 0.10126320 0.21170922 Sr 18.82216334 18.84817864 0.03084278 0.03401668 -0.06316940 -0.19957945 Sr 21.90586494 21.96867510 0.02340496 0.07098175 0.00649501 -0.17303828 Sr 22.02513875 18.85314452 3.16942898 -0.11211569 -0.10343086 0.13786992 Sr 18.79722139 21.98330954 3.10039012 0.05592631 0.01948737 0.30652825 Sr 25.15672698 18.86483309 0.05877439 -0.12906644 -0.03261750 -0.24393898 Sr 28.26451177 21.93387605 0.04228621 -0.02540705 0.10308811 -0.20965228 Sr 28.23039933 18.84952002 3.10336990 -0.00090201 -0.05692319 0.30615786 Sr 25.07023242 21.92412119 3.12281106 0.06361273 0.13866390 0.21677253 Sr 31.35512277 18.77574262 0.04735707 -0.12487214 0.01611602 -0.21369618 Sr 34.45430545 21.92154915 0.03792475 0.13436490 0.05176127 -0.17242656 Sr 34.56612684 18.84846177 3.12385916 0.14634814 0.01245066 0.15993972 Sr 31.32721758 22.01859643 3.18784122 -0.07936352 -0.10161848 0.10068366 Sr 0.06131029 25.10194592 0.02497958 -0.24392705 -0.01074958 -0.24434049 Sr 3.18448494 28.18684403 0.04474930 0.14308124 0.06423054 -0.27302094 Sr 3.08612847 25.11630122 3.08560773 0.36711382 -0.07274613 0.32578370 Sr 0.06239695 28.21322571 3.08997337 -0.27631185 0.03048306 0.23865732 Sr 6.34197870 25.16214954 0.01599596 -0.03540632 -0.09818289 -0.15327941 Sr 9.35483247 28.29103317 0.02477254 0.05942547 -0.01442013 -0.22895397 Sr 9.46926107 25.13885184 3.10869364 -0.05434918 -0.13000063 0.28270826 Sr 6.30369006 28.28503568 3.14311179 -0.03225395 -0.05693586 0.28341250 Sr 12.58944464 25.14675786 0.04882724 -0.06097224 -0.07114992 -0.22068264 Sr 15.71635740 28.28679813 0.01048021 -0.04513760 -0.04161329 -0.15967089 Sr 15.64945609 25.06225796 3.10751005 0.03194092 0.05465771 0.29375627 Sr 12.51329377 28.25256418 3.12020045 0.09519758 -0.01640522 0.26438483 Sr 18.82207800 25.09157029 0.00983168 -0.04609852 -0.02643665 -0.18325943 Sr 21.92692477 28.21197781 0.00337369 0.07177084 0.03352193 -0.20917708 Sr 22.00403835 25.11846477 3.18756463 -0.08347289 -0.09498993 0.13720042 Sr 18.91078292 28.18588407 3.08943578 -0.15210354 -0.00860495 0.32350310 Sr 25.05891982 25.13989587 0.00422870 0.04539013 -0.11404318 -0.18022101 Sr 28.18485679 28.25244661 0.03817013 0.02173609 -0.04382233 -0.20186948 Sr 28.21716139 25.07215599 3.18114087 -0.08637036 0.02744977 0.18114152 Sr 25.07110692 28.19496348 3.08080718 0.01664799 0.07526289 0.28789748 Sr 31.35629685 25.16195407 0.04485272 -0.15759650 -0.05203825 -0.24340192 Sr 34.47730424 28.29928659 0.00997798 0.18252797 -0.04416683 -0.14698005 Sr 34.46602866 25.11817800 3.15642509 0.26512531 -0.03821939 0.12265507 Sr 31.32158598 28.20100400 3.15970907 -0.12052485 0.08814880 0.24618634 Sr 0.04715145 31.41265466 0.03320143 -0.21597822 -0.12455034 -0.22171083 Sr 3.15810765 34.53003976 0.00446163 0.07239024 0.24916718 -0.20595004 Sr 3.08695259 31.43638533 3.08842514 0.24771782 -0.30499508 0.30828035 Sr 0.00441447 34.56411827 3.19552708 -0.22374533 0.18055385 0.06874822 Sr 6.21109859 31.40595959 0.02018775 0.05845745 -0.18386431 -0.25470561 Sr 9.41797021 34.45607284 0.02863490 -0.04303880 0.20842264 -0.16829072 Sr 9.37719049 31.34941552 3.17319102 -0.00619728 -0.17342175 0.23045393 Sr 6.25916714 34.45510748 3.13225112 0.05265920 0.25089380 0.19724957 Sr 12.47334512 31.41761143 0.06197771 0.08125636 -0.22740633 -0.24481286 Sr 15.68381674 34.47808100 0.04821198 0.00061991 0.19432226 -0.22433603 Sr 15.75018033 31.42032832 3.07697134 -0.05655408 -0.33816070 0.34959510 Sr 12.54085780 34.47447402 3.15985911 0.01031344 0.24936694 0.13302596 Sr 18.85027479 31.32656838 0.05291632 0.04288598 -0.05141465 -0.28321205 Sr 21.99827506 34.56976296 0.05753884 -0.05791389 0.13500240 -0.19524181 Sr 21.91268020 31.41799544 3.14887770 0.11098391 -0.24624615 0.17089722 Sr 18.79972872 34.50167232 3.14971515 0.04154615 0.24874449 0.13442990 Sr 25.13881888 31.41643456 0.06191960 -0.13132494 -0.20417470 -0.23179759 Sr 28.20303839 34.46514079 0.00141520 0.04216372 0.19794657 -0.14685652 Sr 28.17293972 31.35807603 3.16514294 0.08636085 -0.13455676 0.22171479 Sr 25.05870424 34.57105436 3.13471952 0.03928867 0.17709880 0.21299955 Sr 31.36032451 31.35731273 0.03918336 -0.18477802 -0.12841004 -0.20817931 Sr 34.45523900 34.47714685 0.02182200 0.13950471 0.14384380 -0.16604931 Sr 34.55391475 31.43174819 3.13161630 0.19002963 -0.21982658 0.22540554 Sr 31.40626469 34.56955737 3.14103238 -0.22033780 0.18483735 0.17954301 Sr 0.00696441 0.05896531 6.22988129 -0.16542414 -0.17692022 0.06200188 Sr 3.17630125 3.17945926 6.24770385 0.13429617 0.18839529 0.09702322 Sr 3.14194189 0.00057370 9.42669084 0.17140673 -0.19104088 -0.04424411 Sr 0.05437578 3.11365168 9.42889236 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-0.08789237 0.35239491 -0.05282016 Sr 28.12855745 0.01734431 9.36025038 0.07821465 -0.23678415 0.05414299 Sr 25.12279189 3.12861959 9.36138002 -0.09951123 0.30882596 0.04567300 Sr 31.38612609 0.04621466 6.22636126 -0.16190644 -0.28496718 0.08732489 Sr 34.55606261 3.11208030 6.21702428 0.22280094 0.19659448 0.08482587 Sr 34.51251318 0.01432412 9.35874659 0.18508703 -0.15015150 0.04252660 Sr 31.38911379 3.07766766 9.37281469 -0.21387910 0.31726493 0.07156743 Sr 0.02075899 6.32721231 6.36094665 -0.19586419 -0.12018844 -0.05583159 Sr 3.12308518 9.38717553 6.25369581 0.27408142 -0.01868625 0.06650296 Sr 3.19732777 6.26871005 9.39025338 0.16197268 0.04060511 0.06759290 Sr 0.03748969 9.39104182 9.36510692 -0.20370349 -0.04199517 0.10460323 Sr 6.29714850 6.32069174 6.32650663 0.06827184 0.04857165 -0.09018266 Sr 9.47350443 9.44401111 6.31224908 -0.08025778 -0.04540864 -0.05235428 Sr 9.43726731 6.21874825 9.40492304 -0.02329566 0.12628906 0.03557398 Sr 6.26199285 9.39217997 9.36325099 0.07213935 0.04029297 0.14740137 Sr 12.59782116 6.26953180 6.25570877 -0.05345759 0.03106394 -0.01532024 Sr 15.63933039 9.45341033 6.28613485 0.11498888 -0.12022655 -0.09029628 Sr 15.69034543 6.31953063 9.39470556 0.15249227 -0.01835439 -0.03893228 Sr 12.58909591 9.32778788 9.39279674 -0.06772786 0.15880738 0.08379035 Sr 18.88387314 6.24961919 6.27394439 -0.10313587 0.06891184 0.11723440 Sr 22.00708371 9.43930368 6.28836605 -0.07810974 0.03192293 0.07714417 Sr 21.92755564 6.37528090 9.47506549 0.10009289 -0.09129089 -0.08859274 Sr 18.82916171 9.46283054 9.39783498 0.00695269 -0.06293088 -0.05391309 Sr 25.05880989 6.32718362 6.22939469 0.02499441 -0.06851740 0.13990590 Sr 28.26177902 9.45076939 6.24560750 -0.07628670 -0.08227075 0.09710141 Sr 28.18650382 6.32801030 9.40506889 0.00489979 -0.06590655 -0.08104352 Sr 25.06279779 9.45650071 9.45317104 0.07960164 -0.07154014 -0.06562763 Sr 31.43126640 6.22554371 6.22960566 -0.29719378 0.06543671 0.14566130 Sr 34.52490700 9.45910102 6.28394520 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