256 Lattice="13.686542510986328 0.0 0.0 0.0 13.686542510986328 0.0 0.0 0.0 13.686542510986328" Properties=species:S:1:pos:R:3:forces:R:3 energy=-524.5191540367407 stress="-24.93034785261291 15.633716732342485 12.01374366144438 15.633716732342485 2.713573119704648 -18.708547052349203 12.01374366144438 -18.708547052349203 7.803499463536909" pbc="F F F" Pd -0.02369526 0.00052395 0.00004679 0.77709423 0.12335059 0.73759752 Pd 1.71596061 1.70425025 -0.00092512 0.71212744 -0.38717363 -1.44927590 H 1.71844734 -0.01754152 1.71289518 -0.38402862 0.81882424 -0.78116243 Pd 0.00038939 1.70735423 1.75703802 -0.52748977 -1.35281441 0.23377838 Pd 3.41068131 -0.02967943 -0.03073815 0.45329198 0.35059769 1.06243547 H 5.17152455 1.70583505 0.02833561 -0.10525736 -0.69831985 0.66141375 H 5.14555091 -0.01547718 1.73916007 0.27448778 0.36064193 -0.54508322 Pd 3.48047328 1.73251021 1.73348925 0.15975268 -2.18025701 1.43228831 Pd 6.85568189 0.02463441 0.00193620 -2.03605903 -0.39118043 -0.43709948 Pd 8.56029658 1.69420220 -0.02507864 -0.70490591 0.90156258 -3.59489987 Pd 8.53894430 0.00660550 1.68046505 0.31617004 -2.65382109 1.16238747 Pd 6.85296809 1.71834928 1.71160862 -2.47039259 -1.44463856 -0.69582582 Pd 10.28143037 0.02575360 -0.00813628 0.16074064 -1.43055131 -1.41264089 Pd 11.99726179 1.71614417 0.00492027 1.35887012 -0.23808086 -1.44911654 Pd 11.96983057 0.01407969 1.70701665 1.43322875 -0.30650875 0.78834492 Pd 10.30110425 1.69974921 1.72260974 0.33692923 -0.82030229 1.47552134 Pd 0.02823895 3.40108611 -0.02544986 -1.01403096 0.45011306 -0.03957338 Pd 1.68065408 5.13097357 -0.00586481 -0.08537635 0.87113931 0.69847810 Pd 1.73230922 3.44109481 1.74408730 1.72258693 2.06979635 1.69963344 H -0.00357789 5.12632944 1.71398203 0.54430623 -0.61410301 0.09536601 H 3.45282447 3.37452369 -0.01946973 -0.44786349 0.03188501 0.65988761 Pd 5.10821440 5.12045120 -0.01369361 1.03794108 -1.48620411 -0.83459780 Pd 5.16449785 3.38662944 1.74048219 -1.76264666 0.23697692 -2.50822597 H 3.42350280 5.09736891 1.74327854 0.36955871 0.44278058 -0.71960323 H 6.79122271 3.40350946 -0.02541627 -0.07764440 -0.12565671 0.51098539 H 8.52445188 5.11443380 -0.01358511 0.79596583 0.21801221 0.24731758 Pd 8.56286885 3.38849209 1.72438339 -0.46789906 2.42803338 -2.25934697 H 6.84464780 5.13400197 1.74765557 -0.30968409 0.14794671 0.32448997 Pd 10.29115088 3.43254687 0.01428987 -0.75290656 2.20886994 -2.47931516 Pd 12.00949952 5.14319610 0.05378855 -0.04335324 -0.06766902 -0.16956867 Pd 11.95211749 3.39111690 1.71909290 2.71207754 1.46961851 1.82626715 H 10.24059794 5.11397967 1.73010596 0.32748923 0.04111334 -0.68868666 H -0.02229298 6.85775939 0.00204026 0.85684553 -0.05156540 0.04114416 Pd 1.70545441 8.53661806 -0.01494787 -1.14283990 -1.56941748 0.63906623 H 1.71932993 6.82703257 1.75530966 -0.03448731 -0.02104261 -0.35888612 H -0.01504300 8.54034473 1.68244567 0.55248151 0.37586102 -0.23066779 Pd 3.43203700 6.80462022 0.05443081 -2.04306553 0.30976428 -0.15658831 Pd 5.16429020 8.51296121 0.02109158 1.77751329 0.42137635 -0.96621193 Pd 5.11326739 6.82995400 1.67548461 1.44485215 1.29586647 -0.05803377 H 3.43223469 8.51354274 1.72480443 0.24399478 0.40543738 -0.74156942 H 6.84843847 6.86022744 -0.01210896 -0.73321238 0.06470418 0.39822766 H 8.53584115 8.51353766 -0.00549799 0.96373155 -0.26005713 0.24796073 Pd 8.52001188 6.86974658 1.68264031 0.60850137 1.36644582 -1.83584159 H 6.81597541 8.57307073 1.73503827 -0.58399559 -0.40528656 -0.28219790 Pd 10.26131530 6.83789201 -0.02659404 -0.54498299 0.75937945 -0.10442033 H 11.94159155 8.58132561 -0.01753199 -0.93850362 0.09796974 0.87178923 Pd 11.95184368 6.87103130 1.67792031 -0.94823633 0.92141148 2.00327999 H 10.25548379 8.55189128 1.72770235 0.40943293 0.10505205 -0.66991264 Pd -0.00410229 10.28147551 0.02564879 -0.52858949 -0.60303683 0.18080810 Pd 1.71971150 12.00606264 -0.00604995 0.60762943 0.52682593 0.23265691 Pd 1.71761295 10.28337528 1.71025807 -0.66826645 -2.04130417 1.32056782 Pd 0.00353493 11.96329794 1.75246460 -0.67711581 -0.11407908 0.35086215 Pd 3.41318278 10.23208572 0.01982226 0.62329737 1.14383329 -0.86108635 H 5.15358499 11.97086843 -0.02988653 -0.39346003 -0.73231169 0.41994158 Pd 5.13624113 10.25812886 1.73367510 2.23105163 1.09899901 0.86297296 H 3.42807607 11.97971903 1.73236966 -0.79527392 -1.16123976 0.02931557 H 6.83919679 10.23640258 0.01775936 -0.71300501 -0.39967051 0.19903582 H 8.56931603 11.99239821 0.02675042 0.88707087 -0.48952008 0.45850690 H 8.55805856 10.26868244 1.66707048 1.18826343 0.73004569 0.29320030 H 6.83805113 11.94767228 1.71073603 0.00737276 -0.26100641 0.51459645 Pd 10.29223067 10.23360733 -0.00586442 -0.82248531 -1.15850276 0.40800104 H 11.99215865 11.97291613 0.02384076 -1.02693370 -1.05608422 1.01053818 Pd 11.95244618 10.28345832 1.69441128 0.97529307 -1.25413091 -0.19723622 Pd 10.26829657 11.94540568 1.70416957 -0.22158636 1.21740155 -1.20096130 Pd 0.02072235 0.04689509 3.42601498 0.92894727 -0.15728036 -1.06579055 H 1.70554400 1.68086835 3.46774465 -0.88715074 -0.22458850 0.01026311 Pd 1.72223732 0.01533298 5.14011537 0.18057676 -0.52662143 -0.98193493 Pd -0.02540582 1.73645166 5.09036956 0.49978194 0.43739235 0.30353155 H 3.47476184 -0.00939138 3.45374074 -0.16537565 0.30847779 0.64633886 H 5.11401970 1.72843951 3.43762540 0.17839407 -0.02712748 -0.11776346 Pd 5.13788914 0.00057664 5.10233714 -0.19929474 -1.33551712 -2.02005255 Pd 3.44200361 1.72034407 5.11463382 -3.29580149 1.49348450 -2.44897279 Pd 6.81683406 0.02136062 3.48003813 -0.63440901 0.12718582 -0.55530053 H 8.55716655 1.68399910 3.38986815 0.09144708 -0.34724824 -0.50843657 Pd 8.56063338 -0.01315603 5.14825688 0.66294420 0.02131064 -1.24925172 H 6.87506305 1.74254785 5.11882841 -0.01395413 -0.71455341 0.32086150 Pd 10.30299414 0.03711517 3.38859976 0.08935184 -0.09577005 1.59876692 H 11.98019893 1.69507077 3.42651249 -0.57646104 -0.17862244 -0.16051312 Pd 12.00493990 0.01136786 5.12139722 -0.31507392 1.99445447 0.14189866 H 10.24659359 1.69361335 5.13602999 0.11260214 -0.53988581 0.13397824 Pd -0.02580691 3.43673236 3.39191865 0.28457192 2.00515803 1.03159911 H 1.72830360 5.12291738 3.42322692 -0.40240966 0.09967874 -0.03044351 H 1.68047366 3.39963564 5.14974669 -0.63493432 -0.03616624 0.15980359 H 0.04333356 5.17155730 5.16843910 -0.04025777 0.07192780 0.25223328 H 3.43782308 3.42121753 3.39664908 0.19829988 -0.19805039 0.00197325 Pd 5.14178074 5.13172976 3.39699045 -1.63581184 0.14859588 -1.47779769 Pd 5.08146957 3.42323254 5.15210581 0.58810544 -1.29839454 1.13698547 Pd 3.43607435 5.13737107 5.11100391 -2.02246242 -0.91972879 0.21366606 Pd 6.84299646 3.42248412 3.37593829 -0.16271556 -2.85052960 0.78483564 Pd 8.56218097 5.11504730 3.40855272 3.44665358 1.94985571 -1.93711714 Pd 8.55075500 3.43883028 5.10554821 1.68747051 -3.49472434 1.96621059 Pd 6.83933155 5.13094893 5.14415560 -2.89876553 -0.29730723 2.72715407 Pd 10.28651704 3.38066308 3.43667417 2.06142207 -0.09947130 1.36151455 H 11.98560316 5.08454634 3.38630428 0.03583392 -0.24898504 0.13596704 Pd 11.97832290 3.43549920 5.13942131 -0.68283190 -0.27482375 1.34349983 H 10.23556239 5.16257857 5.12834653 -0.00122371 -0.26979302 -0.07303728 Pd -0.00530003 6.85062600 3.38531001 2.29774241 -0.03467474 -0.16127944 H 1.70293111 8.53111657 3.40455345 0.08524845 0.01824003 -0.35289388 H 1.74729881 6.86578602 5.09280886 0.10017565 -0.30733409 0.38845772 H 0.03640453 8.54038824 5.12320503 0.00303820 -0.38359941 0.55834259 Pd 3.42978623 6.85451327 3.42567501 -2.93304849 2.82840294 -0.30380706 H 5.10123608 8.55493539 3.44759724 -0.02405053 0.05510700 -0.52943749 H 5.13706791 6.85993893 5.10542772 0.07482587 -0.37175698 -0.14552767 H 3.43644716 8.56513735 5.10973515 -0.51073962 0.23477348 0.29891047 Pd 6.85949401 6.83265546 3.44816180 -1.62353789 3.00967327 -2.25198364 H 8.54389132 8.59712805 3.44721677 0.23679334 -0.13668604 0.61006362 Pd 8.56061268 6.87409749 5.13596501 4.70252365 1.05030109 -0.12624408 Pd 6.84832500 8.52495832 5.13814534 -2.97800133 2.28774199 -1.37116971 H 10.29370644 6.80940214 3.44900054 0.06503516 0.27741521 0.12273756 H 11.93805499 8.51361893 3.38384996 -0.24912397 0.00252294 -0.04449058 Pd 11.98106767 6.83534824 5.10814422 -0.96689910 -1.09148186 -0.16557823 Pd 10.25161746 8.58656646 5.13619924 2.36168623 -1.74605897 -0.34380287 H 0.01253361 10.25987405 3.39228660 0.55806396 0.82119153 -0.88874809 Pd 1.72132957 11.95588767 3.39577786 -0.36761528 0.70179217 1.85347441 H 1.69561098 10.27708187 5.09896839 0.40893634 0.43553701 0.58466929 H 0.03052970 11.95986509 5.13512322 0.77059883 -0.37605352 0.44459995 Pd 3.40991488 10.28525692 3.43823455 1.01199477 -1.02698791 2.29392929 H 5.14014381 11.96742612 3.47520285 0.13000361 -0.35221664 -0.13266382 H 5.07625658 10.30354688 5.07445246 0.24633662 0.10378728 0.53427120 H 3.39792996 12.00491644 5.12160141 -0.84723567 -0.46687526 0.00179836 H 6.82388214 10.24769924 3.44673522 0.32279722 0.64852670 0.42416030 Pd 8.55512158 11.95562524 3.39402037 -1.09153105 0.50964974 -0.93573807 Pd 8.58755121 10.23450998 5.14343220 -0.65083723 1.36216695 -0.53033090 Pd 6.83343982 11.98941825 5.16065153 -1.58793544 0.30303397 -0.40256602 Pd 10.28828868 10.27386654 3.39370995 1.31829715 -1.01551712 -0.30163776 H 11.99201523 11.95454301 3.45224608 -0.80403172 -0.77358639 -0.83338526 H 12.00790907 10.22715973 5.14827854 -0.85503128 0.19744277 0.42104990 H 10.21981732 11.94865586 5.17343717 -0.04988771 -0.83445877 0.01503238 Pd -0.01524627 -0.01405708 6.84738607 0.27574433 1.16087903 0.82531721 H 1.68101295 1.70560147 6.84852583 -0.63072429 -0.90340903 -0.38636506 Pd 1.73575459 -0.00521975 8.61102539 -1.35063019 0.20680953 -0.79425184 H -0.02700531 1.67609985 8.53131186 0.68379095 0.16250777 -0.11032810 Pd 3.41781714 -0.02798478 6.85390685 -0.43817653 -1.05326799 2.22352772 Pd 5.12210560 1.68958384 6.84427755 -0.09697164 0.76194568 1.61549225 H 5.13360593 0.00372439 8.55534387 -0.11052272 0.36848733 -0.49950357 H 3.40468052 1.73272818 8.54715235 -0.28670636 -0.37499922 0.57930203 Pd 6.83952793 -0.00591843 6.82126291 -0.00171450 -2.32289871 1.13169305 Pd 8.54014289 1.72385917 6.87434982 0.69272295 1.85226635 -0.23300284 H 8.54654224 -0.02427612 8.57742176 0.09654426 0.73586322 -0.89908737 Pd 6.83321957 1.73340328 8.56210307 1.26277118 -0.51967618 3.80671420 Pd 10.27349425 -0.00987723 6.86108491 0.63770236 -0.58690149 -0.22037102 H 11.94794855 1.70617066 6.87370981 -0.43443451 -0.40420483 0.48387819 Pd 11.91603811 -0.01959799 8.58168825 0.00628573 0.94344198 0.82036665 Pd 10.29413638 1.73222259 8.57875726 -0.60536328 0.73364901 2.29482146 Pd -0.02711398 3.42525698 6.79829677 -0.45300283 -0.20421012 0.00898619 Pd 1.73462786 5.12533593 6.84253085 -0.70265584 -1.66295050 -1.38952037 Pd 1.71218711 3.40150176 8.55863158 0.48672708 -1.45594594 -2.98145179 H 0.02479170 5.15888715 8.52635534 0.77783418 0.10385211 -0.05992477 H 3.40192781 3.36782009 6.80481501 0.32353530 0.08471316 -0.35168823 H 5.16899510 5.15767146 6.83505044 0.10333356 0.06321265 -0.08735391 Pd 5.11789798 3.43241646 8.57897956 -1.12451141 -0.39503073 -1.42903613 H 3.40537647 5.12412440 8.52175698 -0.51891215 -0.17333593 0.23320399 H 6.83184197 3.41006786 6.83099500 0.05294329 -0.11518539 0.33191713 Pd 8.56444364 5.16181374 6.82676641 4.51279618 -1.45720909 3.14101275 H 8.54001984 3.45599624 8.52873629 -0.00720354 -0.42100577 -0.25694968 Pd 6.81514923 5.13748961 8.52160680 1.14227225 -1.25998830 0.55351148 H 10.27796220 3.42676713 6.79443561 0.08842810 -0.28733627 0.25680677 H 11.97796509 5.13989299 6.84135955 0.24527921 -0.00459843 0.02209335 Pd 11.94628978 3.44324503 8.51940352 -0.88673133 0.95343742 -0.16999413 H 10.25905248 5.13241121 8.50511935 0.64342172 0.19536482 0.29805680 Pd 0.01775999 6.84420187 6.87512208 -2.39883820 -0.11527222 -1.28110608 Pd 1.69926156 8.55693858 6.83859846 -0.87732020 0.48545220 -2.74550154 Pd 1.68207922 6.83799634 8.56171159 0.77195129 1.33683683 3.06483830 H -0.00692639 8.56705259 8.55167394 0.59349758 0.16716183 -0.17120000 Pd 3.40753085 6.87032569 6.85784489 3.82801243 1.23009449 0.06184357 H 5.12650774 8.58299373 6.83319114 0.32827638 0.25784008 -0.27958750 H 5.13950179 6.85707566 8.58262867 0.68951154 -0.17257797 0.30633586 H 3.43748937 8.53015039 8.55013691 -0.65902302 0.44415806 -0.31936374 Pd 6.86189997 6.86635848 6.85027314 -2.65273648 2.73032168 2.97287888 H 8.57675328 8.55598929 6.83745537 -0.15116507 0.63923506 -1.04641532 H 8.56165902 6.84132365 8.53034973 -0.43087164 -0.32485593 0.51458931 H 6.90542093 8.57576203 8.52640580 -0.11955575 -0.12719893 0.27714751 H 10.24497430 6.84972588 6.86421711 0.54515660 -0.02900674 -0.59374839 H 12.00008903 8.57184681 6.81492834 -0.53225090 -0.51899770 -0.15828359 Pd 11.97073537 6.87388961 8.54639822 -0.70501341 -0.81550898 -2.27628982 H 10.27514034 8.52698107 8.55271142 0.58679038 0.06385506 1.23703296 Pd 0.00043928 10.32653125 6.87479864 -1.35690362 -0.07735901 -0.90020218 Pd 1.70211599 11.96422379 6.86874868 0.00807719 1.45778260 -0.97987335 Pd 1.73925644 10.23077572 8.54893754 -0.68789218 0.32322390 3.07929370 H 0.00350018 11.96238369 8.53161077 0.77104429 -1.25013770 -0.44566138 Pd 3.44112980 10.24502481 6.84693233 3.42914787 0.52639680 -1.29127223 H 5.09960196 11.97310992 6.87504845 0.43575673 -0.58719029 -0.44999211 H 5.11316737 10.21683038 8.59406830 -0.18301400 0.33317012 0.38111048 H 3.42346886 11.97612992 8.57176825 -0.35002774 -0.75219595 0.11275918 Pd 6.82945744 10.25220441 6.84877459 -1.13365966 0.40503355 3.43407952 H 8.55042459 11.98880459 6.81584458 -0.50283481 -0.81497767 -0.51941428 H 8.54649191 10.30072752 8.59932425 0.52250693 -0.29825098 0.06273551 H 6.84229841 11.99870170 8.56461153 -0.45933098 -0.27970460 0.14301199 Pd 10.26638027 10.24046723 6.81618638 0.89295786 0.70194856 3.15664481 Pd 11.98743801 11.96486887 6.83562481 -1.09913406 -1.08758600 0.23863353 H 11.94439682 10.29553655 8.56576414 -0.50806792 0.44602915 0.40387708 H 10.27409308 11.98410466 8.54138405 0.81925467 -0.51460562 0.10740609 H -0.01989680 0.00849448 10.28419494 1.24136299 0.31698392 -0.00826063 Pd 1.68185974 1.68864942 10.23337057 -1.16759461 -2.01345698 0.75838532 Pd 1.73805710 -0.02034504 12.00334627 -0.51196623 1.11494901 -0.27911488 H 0.00812739 1.76353909 11.97364388 1.17057171 0.40028036 -0.74775735 Pd 3.40487799 -0.02844363 10.28001694 2.73833049 0.70392396 0.19441026 H 5.16836025 1.73154225 10.29295410 -0.32519958 0.13008596 -0.61726318 H 5.07995845 -0.00874047 11.98965555 -0.37781926 -0.03548944 -0.52753298 H 3.45184069 1.67843679 12.00522826 -1.14720420 -0.20669991 -0.77262451 H 6.79172437 0.01234921 10.24753553 0.10735540 0.25065239 -0.24266350 H 8.55537517 1.68852309 10.24781339 0.45673657 0.60076331 0.33523453 H 8.54374589 -0.00249747 11.93642151 0.53218391 0.57314620 -0.06890987 H 6.82399381 1.68814475 12.00679982 0.59309125 0.55036780 0.02482999 H 10.29753424 0.02383961 10.22099486 0.45224823 0.72079157 -0.46936948 H 11.98490327 1.69774677 10.25295872 -0.80261272 0.13999002 -0.86908541 H 12.00964557 -0.01102107 11.92053635 -0.59548131 0.56850396 -0.10184114 Pd 10.26911219 1.71677799 11.97645556 0.56641604 -0.45182528 -2.43987957 Pd 0.03061864 3.39827298 10.28594624 -3.38831326 -0.09617838 0.04252271 Pd 1.69086830 5.13801898 10.28161231 -0.58812386 1.48663201 -0.90359789 Pd 1.71105265 3.41415077 11.95870201 -1.00870197 -1.38050998 3.30740304 H 0.02362449 5.17753387 11.98155376 1.01032932 0.15486887 -1.03279437 Pd 3.43606207 3.40963774 10.24148608 1.74755710 -2.92289896 0.70624935 Pd 5.09243173 5.11537020 10.30892531 0.78656090 0.45736892 0.20509147 H 5.14548515 3.43347177 11.98260952 -0.62232683 0.49755185 -0.35804136 Pd 3.41562549 5.11576769 11.95932944 0.79169902 0.44171952 2.74387395 H 6.85089678 3.44354244 10.24898692 -0.00318724 0.05260768 -0.28592624 H 8.54269449 5.18453172 10.23584280 -0.10557129 0.05431026 0.21713997 Pd 8.53490625 3.41942069 11.99039038 -0.68003118 0.70659451 -2.27777715 H 6.80002947 5.09865371 11.98758908 0.02641379 0.29925735 -0.37961165 H 10.25420787 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