256 Lattice="13.75973661948083 0.0 0.0 0.0 13.75973661948083 0.0 0.0 0.0 13.75973661948083" Properties=species:S:1:pos:R:3:forces:R:3 energy=-520.6695719463085 stress="-0.7039912109551665 -13.723378356507101 -17.26542836273606 -13.723378356507101 -16.01775693860648 12.241438670535018 -17.26542836273606 12.241438670535018 12.629721243715228" pbc="F F F" H 0.00503308 -0.00273861 0.00088867 0.98355353 0.56055824 0.60977401 Pd 1.74118794 1.71124185 -0.00902489 -1.32881378 -0.71997169 -0.16886733 Pd 1.72920142 0.00072177 1.67276755 -0.34226026 0.14532787 0.45761353 H 0.01173366 1.75193967 1.70132106 0.64309974 -0.34949431 -0.38881353 H 3.46680155 0.03326412 0.00140256 -0.58054829 1.08233225 0.71300924 Pd 5.17311160 1.74685125 -0.02912450 -1.07765249 -1.49267464 -1.11990153 H 5.10828298 -0.00967256 1.73329630 0.46244071 1.06636665 -0.28336923 Pd 3.45563325 1.72642592 1.73107042 -0.76139968 -0.50438411 1.85692947 Pd 6.90486683 0.02390366 -0.02534629 -0.73184323 -0.93094420 -0.26711542 Pd 8.59641754 1.74534467 -0.03325009 1.17124115 -1.60873199 -2.83594033 Pd 8.59326565 -0.00681634 1.69527197 0.93746343 -0.95887586 1.50333954 Pd 6.85172989 1.72636434 1.68913425 -0.79501521 -0.60218288 3.06845044 H 10.34422595 0.02862179 0.02467982 -0.91657753 0.66041718 0.76335789 H 12.04632810 1.72504302 0.01357301 -0.70080604 0.88519211 0.78760947 H 12.06201131 -0.03092947 1.71793251 -0.38134309 0.80879230 0.56787982 Pd 10.34014449 1.74339199 1.73741266 0.93465671 -2.54129990 0.95869059 Pd 0.00677281 3.41012887 0.00855437 0.44966207 -0.03048914 1.95718779 Pd 1.73430884 5.10204719 0.05210563 -1.91392670 0.33876993 0.03959109 H 1.74400911 3.43689840 1.72724039 0.26145298 0.16544965 -1.14875990 H -0.02523538 5.12930717 1.70472353 0.49887700 0.29451131 -0.61556182 Pd 3.43405738 3.39692573 0.02729423 -0.12217590 0.22634502 -1.29407210 Pd 5.15831651 5.15394255 -0.01463980 1.98602465 0.81820310 0.36736202 H 5.21378584 3.40300050 1.69554824 -0.21765786 -0.43265963 -0.67069238 Pd 3.40314341 5.16606710 1.74247969 0.01621955 -1.52292036 0.05174284 Pd 6.87594206 3.41172485 -0.00067971 -0.18729588 2.52732140 -1.31872602 H 8.58541659 5.11007951 0.02072443 0.47481900 -0.29958216 0.29191426 Pd 8.60824766 3.45355822 1.68936480 0.23575067 2.17313897 1.95375666 H 6.89879254 5.15535699 1.70365917 0.26360533 -0.31524008 0.01363204 Pd 10.30629785 3.42625325 -0.02214923 0.52482027 1.40776074 -1.72716741 Pd 12.01180226 5.17566122 0.00826240 -0.15307559 -0.21995856 0.21296858 Pd 12.01409006 3.44782685 1.71270595 0.50154764 1.47829494 0.94950430 H 10.34279221 5.18166220 1.72477748 0.31371903 0.44529346 -0.66159809 Pd -0.00315688 6.87887392 0.01515576 1.32391897 -0.26732354 1.12146909 H 1.65832253 8.59273726 -0.01939611 -0.22579184 -0.28832526 0.71239918 H 1.70334502 6.93177804 1.71572893 -0.25048513 -0.10282120 -0.02553962 Pd -0.01135865 8.58287893 1.69090579 -0.15727652 0.75883666 -1.01753293 Pd 3.44696187 6.89606620 0.03109406 -1.42562511 0.72629880 -1.27708015 Pd 5.15071108 8.62247100 0.02165965 -0.08402769 -0.81850754 -2.47380554 H 5.18208943 6.94016291 1.71583696 -0.73068005 0.21440594 -0.24358008 Pd 3.46816313 8.57675674 1.73474778 -1.66104671 0.69710388 -2.04281904 H 6.87930452 6.86653603 0.04565308 -0.20947247 0.29016684 0.22925802 H 8.56553823 8.58951823 0.01054193 -0.18346085 0.09003870 0.74975806 Pd 8.58436365 6.86522562 1.69071481 -0.86878333 -0.05400363 -1.68664460 Pd 6.88411079 8.57982203 1.70097353 1.17550505 -2.25221659 0.96470650 Pd 10.34703972 6.86732207 0.04451205 -0.71558728 0.81706640 -0.37593212 H 12.02192709 8.61767742 -0.00130073 -0.27042545 -0.40101206 0.85191620 Pd 12.04774809 6.90378743 1.69812436 0.12935086 0.70492642 0.92984662 H 10.35396329 8.62974963 1.66311464 0.19420396 -0.54397044 0.17530594 H -0.02836916 10.29842673 -0.00550091 0.81999593 0.00623668 0.82392679 Pd 1.72828376 12.05948555 -0.01660875 0.60873764 -1.13122743 1.01615475 Pd 1.73776160 10.30065502 1.66580205 -0.28709334 2.33316121 -0.37022724 H 0.00630292 12.04050043 1.75420271 0.82785297 -0.33510201 -0.50961752 H 3.44324956 10.36150050 0.00391298 0.07665625 0.25424440 0.60363701 Pd 5.17529842 12.03862156 -0.02825037 -1.70728129 -0.15484825 0.11678281 Pd 5.17906041 10.33537092 1.74141731 -2.10954171 2.27301824 0.54200431 H 3.47896755 12.04069714 1.72753087 0.22453409 -0.33480700 -0.38572919 Pd 6.91070050 10.29678363 -0.01021318 1.63349624 0.39727937 -2.99732869 H 8.58055493 12.02102414 0.00423790 -0.70990570 -0.76724913 0.79245940 Pd 8.58426917 10.33768698 1.71126144 3.75112101 -0.91058060 0.00857750 Pd 6.91255163 12.04779801 1.67530929 0.44354756 1.95666622 0.14881120 H 10.33651832 10.29055284 0.03016149 0.46839812 0.59303904 0.60476387 Pd 12.01132013 12.02908254 -0.02500092 -1.19571032 -0.56133440 0.65242821 Pd 12.05259678 10.32997174 1.73045958 -2.36531958 -1.05134031 0.87527490 H 10.32033929 12.03291879 1.72705956 0.09500398 -0.73253544 0.02836557 Pd -0.01230801 0.02261781 3.41190130 0.60958147 1.20610549 -0.85957183 H 1.72565133 1.70083228 3.43468416 -0.34983207 -1.13731762 0.21160083 Pd 1.72384017 -0.01786929 5.14268876 -0.56018663 -1.63058078 -1.42225145 Pd -0.00951016 1.72842871 5.18878971 -0.23440475 1.33926893 -0.38188346 H 3.45812667 -0.03095297 3.44380116 -0.58022668 0.70465745 -0.07571940 Pd 5.16473290 1.68890354 3.41124512 1.15927166 -1.28422255 0.19884997 H 5.17108849 -0.02265958 5.14538915 -0.60191286 0.57913560 0.31552091 Pd 3.41947808 1.71677231 5.15340807 -1.37182179 -0.19256262 -3.71839318 H 6.85168053 -0.00587643 3.45858979 0.17195394 0.50421935 -0.71855700 H 8.60344011 1.76038110 3.41499465 0.15072733 -0.46751847 -1.15023263 H 8.62751254 -0.00719039 5.14564146 -0.09419297 0.24429825 0.27845289 H 6.87607505 1.68848036 5.20627205 -0.26496717 0.45394234 0.42109602 H 10.31156749 -0.01230049 3.44368959 0.01411509 0.63739265 -0.75595833 Pd 12.04947815 1.71162422 3.43262340 -0.94792285 -1.36214801 0.98608658 H 12.05705846 -0.02414303 5.18768520 -0.10240379 0.86366071 0.01538429 H 10.31021922 1.68913931 5.13576573 0.74288836 0.53379405 0.56501411 H 0.00694891 3.45221115 3.41991594 0.16495369 -0.15877397 0.36540423 Pd 1.69104960 5.14764806 3.40305553 -1.74840560 -3.50316858 -0.11260204 H 1.72509396 3.46650675 5.12701270 -0.06256953 -0.68982075 0.19983319 H -0.02332258 5.16717425 5.14896637 0.41556389 0.89220461 -0.28488667 H 3.44868919 3.46473306 3.42031132 0.40303289 -0.11549209 -0.10451539 Pd 5.13642053 5.17115556 3.40845223 2.78441353 -1.70959808 -1.57823870 Pd 5.16930563 3.47013279 5.18793622 0.75690250 0.51510719 -3.38853192 H 3.48871263 5.17201019 5.19062025 0.41672086 0.12874277 -0.38063219 H 6.93665020 3.39607879 3.44595721 -0.36892421 0.01163163 -0.44096387 Pd 8.57615878 5.13548095 3.41939837 -2.09382785 -2.53211665 0.02175650 H 8.58159203 3.44200343 5.13724763 0.50812869 0.24217060 0.86094075 H 6.90796996 5.17118801 5.20385442 -0.19691152 0.18336155 0.43456347 H 10.35029952 3.44319290 3.43495322 0.54129505 -0.33995512 -0.32639390 H 12.03068159 5.17625025 3.44827854 -0.23906029 -0.02728972 -0.14300539 Pd 12.05801638 3.43498984 5.15495675 0.92817738 -0.53637666 -2.08440928 Pd 10.35367691 5.12294564 5.15821867 1.44098862 -0.09194491 -1.63712602 Pd -0.01694592 6.90158923 3.44055065 -2.05129563 -1.96281168 -1.62266026 Pd 1.76486121 8.59335474 3.46089768 0.02923894 1.72664987 -0.72872331 Pd 1.74306402 6.86162147 5.15648225 1.75735017 -1.34289888 3.83869859 Pd 0.00854737 8.57978052 5.16187241 -2.14181283 2.30523831 1.25929470 Pd 3.46935195 6.91195624 3.42027719 -0.73994897 -0.61580666 -0.01386125 Pd 5.12871248 8.63031661 3.46022513 0.73933117 1.86473615 1.46408014 Pd 5.13047660 6.83713749 5.15589910 -1.03520842 0.46694582 1.38704248 H 3.47092775 8.61241922 5.18891866 -0.48085837 -0.12956764 -0.51769339 H 6.88846539 6.88387939 3.46025206 0.01563134 0.09461680 0.07103871 H 8.54053583 8.59333769 3.46128392 0.48824711 -0.02715368 0.09645139 Pd 8.57850797 6.85360258 5.19039578 -0.45483318 1.36742962 -0.62427185 Pd 6.87259962 8.60859000 5.19076353 -0.24588208 1.68750406 -1.43269140 Pd 10.28631118 6.85029420 3.43320378 3.08066983 1.17412397 -1.70565883 H 12.02381278 8.60750926 3.43322085 -0.46799219 -0.20086358 -0.52437617 H 12.03520736 6.84282334 5.18190972 -0.69049934 -0.20908402 0.12275264 Pd 10.34025525 8.58755381 5.13143988 2.50249841 1.61151694 1.06558671 H -0.00284843 10.33817302 3.39183519 0.68272964 -0.57037381 0.40274061 H 1.69039444 12.06105302 3.46198830 0.03621216 -0.45002122 0.80249663 Pd 1.72663333 10.29180346 5.16362873 -0.50704240 0.67935277 0.02564474 Pd 0.00269323 12.01607106 5.16481520 1.06783607 -1.15903536 -0.01643498 H 3.46850396 10.30560673 3.44343333 -0.11173334 0.17617903 -0.27718243 Pd 5.10653015 12.02538103 3.47263901 0.43135980 -0.45152069 0.48034450 H 5.11786225 10.33043408 5.20588641 0.03906593 0.83890242 0.25768235 Pd 3.44206409 12.02661517 5.16017056 -0.93675624 0.56582054 -0.93698123 H 6.85684560 10.29673656 3.41952742 0.01202253 0.37193056 -0.58676473 Pd 8.63254599 12.05425332 3.42965926 0.88886734 0.30744930 0.88126730 Pd 8.59674675 10.30512875 5.14596559 1.42908237 0.83770750 -1.32957198 H 6.93793867 12.05224780 5.12456007 0.38259924 -0.36077300 0.23005278 H 10.31158139 10.32934095 3.47176975 -0.57676983 -0.06325897 -0.31513499 H 12.03967308 12.00803904 3.41880632 -0.01653856 -0.55133292 -0.53638422 H 12.00543169 10.30828637 5.12620227 -0.16339097 0.02060662 0.51595427 H 10.29610066 12.00475766 5.11458086 -0.68979505 -0.03908630 0.41270542 H 0.00871377 -0.00021744 6.85902361 1.06022801 1.16096195 0.00402571 Pd 1.68684631 1.71557117 6.85861156 -1.54196180 1.85771412 1.41480475 Pd 1.69238172 -0.01631364 8.57856161 0.03729048 0.05764275 2.03071890 Pd -0.01831182 1.76042706 8.55044082 0.11028693 0.20039541 0.27772610 Pd 3.43300450 0.01186524 6.85066156 0.73028277 -2.34077548 0.45229458 Pd 5.14337618 1.72534060 6.90064280 0.76948547 -1.61880607 0.01029067 Pd 5.18858695 0.01088497 8.56614172 -0.56363627 -2.04240617 1.18828605 H 3.46754868 1.73930997 8.59140000 0.05748063 -0.66076066 -0.29846888 H 6.89314740 -0.00646348 6.89086154 -0.27442523 0.63025418 0.61762427 Pd 8.61647439 1.70677525 6.85195157 1.48163982 -2.45168205 -1.04454837 H 8.56515477 0.01476353 8.59673738 0.29129772 0.75683224 0.38884919 Pd 6.85989776 1.68564761 8.55937899 1.68872445 -1.06913645 0.65619473 H 10.27927038 -0.01651750 6.85479830 0.42402721 0.61010255 0.47120840 Pd 12.03117319 1.69174058 6.89704271 -0.55233536 -2.01215399 -0.63027064 Pd 12.06484229 -0.00228556 8.63620500 -1.20764423 1.43760468 0.34472751 H 10.33985558 1.71651072 8.58387496 0.65801606 -0.40509275 -0.25585179 H -0.02328564 3.42203242 6.84883492 0.16518500 -0.80384099 0.38196394 H 1.76853910 5.17400063 6.84571523 -0.49788749 0.41804960 0.60413678 H 1.73687810 3.44706337 8.58472467 -0.51790175 -0.06349345 0.14347524 Pd -0.02367913 5.15872403 8.58117327 0.54571234 -1.15963235 0.26055282 Pd 3.41773474 3.47397197 6.89703412 -3.18775299 0.60588956 0.92428007 Pd 5.18561691 5.14341641 6.89192534 -0.04442451 0.44661962 0.41428880 H 5.16176041 3.45513407 8.59103959 -0.03472543 -0.15124758 0.15385567 Pd 3.45689660 5.13550166 8.59606879 -3.21896867 -0.93100434 -0.95447537 Pd 6.86401273 3.45082918 6.83032104 1.95801592 0.42690914 0.35535592 Pd 8.57563184 5.17407834 6.86569281 0.60167965 -0.50298623 2.86352700 H 8.62571901 3.41778161 8.55749511 -0.30461185 -0.36596144 -0.20753149 H 6.91213984 5.11807410 8.66200713 0.04628082 0.16915694 -0.01036777 Pd 10.32027228 3.45109076 6.90215004 -1.57050365 -1.60501746 1.62124740 Pd 12.01815806 5.16069907 6.87905463 0.97950917 3.05461787 1.36602236 Pd 12.05376606 3.40763258 8.62351972 -0.47738724 -1.20242076 2.37669068 H 10.33390605 5.19797145 8.56422141 0.47939439 -0.37553906 0.30131309 Pd 0.01605950 6.89348283 6.87826584 -0.85684737 -1.03030050 -0.86847772 H 1.68649979 8.63846707 6.88319431 -0.51853931 0.04457781 0.32076171 Pd 1.69579809 6.93071014 8.62168393 -0.54007097 -0.40025145 0.41926207 Pd -0.00937982 8.61797206 8.57403507 -0.73628378 1.22843430 0.89996223 H 3.44543573 6.88866822 6.87735804 0.08216583 -0.19104916 0.52956553 H 5.18003680 8.59291308 6.86204031 0.35353642 0.10390435 0.27235140 Pd 5.13938325 6.90727923 8.62453357 3.20199003 1.05000743 -1.70399270 Pd 3.46640520 8.61289181 8.60362116 -1.84312286 0.40354732 -1.31375815 Pd 6.88724707 6.89244251 6.85801821 0.82672538 1.34827636 3.13810456 H 8.58143472 8.61287154 6.89130423 -0.27156841 0.44411836 -0.69350858 H 8.62102395 6.89132631 8.60943027 0.17701238 -0.42434418 0.27188845 H 6.85095299 8.60941997 8.56972572 -0.24726064 0.42459831 0.06295359 H 10.30753798 6.87199864 6.90116898 -0.05674717 -0.32519231 -0.83768695 H 12.03241718 8.61639137 6.84898616 -0.29722302 0.10816835 -0.24278016 H 12.04962985 6.84691118 8.56278967 -0.18389907 -0.50513990 0.40048763 H 10.32370687 8.65603905 8.56599710 -0.26621637 0.01384276 0.49032110 H 0.00054040 10.34901942 6.90401292 0.36140663 -0.25849208 -0.44407911 H 1.73009985 12.07012215 6.90104692 0.21163956 -0.74324831 -0.81844361 Pd 1.70543807 10.30552040 8.64455351 -1.42709817 1.43435792 0.38592931 H -0.00913598 12.00284092 8.58139169 0.85195151 -0.25839877 0.55425075 Pd 3.39868393 10.33632275 6.89030381 -0.01707571 -0.56969390 -1.16604632 Pd 5.18239522 12.05870019 6.93970074 0.66658173 1.95457877 -0.22862806 Pd 5.15787806 10.33591091 8.61056645 1.24966925 0.82474561 1.61768347 H 3.39593938 12.06453397 8.64837358 0.19976805 -0.55835267 0.33055761 Pd 6.89080739 10.35087895 6.90626055 -1.10035526 -0.58036928 -0.06562096 Pd 8.62413838 12.03263033 6.90492538 0.49429993 1.88471277 -0.92250073 Pd 8.60578189 10.31698272 8.61451666 0.57622012 -1.86927311 2.58008808 H 6.88567508 12.01361592 8.58401310 -0.33127860 -0.68375514 -0.57786868 H 10.31009134 10.35090266 6.84498261 -0.33810790 0.80944279 0.23836354 Pd 12.02200199 12.02528870 6.90037975 -1.35506232 -1.77283113 -0.52792884 H 12.02378430 10.34059144 8.64941090 -0.35373625 1.34853378 -0.05489587 Pd 10.35806768 12.03244247 8.62001752 0.39966255 -0.84988448 1.01304395 H -0.00659410 -0.03366509 10.33532463 0.99401126 0.50075401 -0.36524506 H 1.72774404 1.76832367 10.31551789 -0.17258807 -0.24396214 0.17431193 Pd 1.73481861 0.03238194 12.06221575 -0.50647875 1.28048828 -2.13824923 H 0.02251090 1.68147241 12.06452643 0.65103765 -0.02394674 -0.45957439 H 3.44422698 -0.00282482 10.35500997 -0.31763001 0.62290786 0.16170497 Pd 5.18550495 1.71343190 10.34073742 -0.43438795 -1.57994484 1.45183108 H 5.13899426 0.02765425 12.05867118 -0.45915793 0.78130056 -0.35943214 Pd 3.42475306 1.73413048 12.04580123 -0.54285879 -0.08575560 -0.07176882 H 6.87737671 0.02273811 10.29863945 -0.40162125 0.75144752 -0.64594902 Pd 8.56882886 1.72157373 10.33486807 0.95338366 -1.66613316 -1.01942349 H 8.57671854 -0.03162587 12.05660309 0.86002658 0.74072982 -0.78745243 H 6.87386335 1.70703070 12.02413663 0.38277601 0.67738624 -0.74618390 Pd 10.33498401 -0.02922573 10.33719518 0.24307697 0.74855055 -0.41846940 H 12.07168395 1.68472701 10.32753518 -0.67879210 -0.06926004 -0.14547584 H 12.06579012 0.02432147 12.07366304 -0.96204122 0.50414124 -0.57314443 Pd 10.30026609 1.72352113 12.04146462 1.41538415 -0.55645236 -0.15986987 Pd 0.02309275 3.44168945 10.30685373 2.13703182 -0.71654424 0.92275511 H 1.72512561 5.19173180 10.33548420 -0.17178104 -0.26520206 -0.03112254 H 1.72310127 3.44510438 12.02892305 0.14413408 0.33159767 -0.48651227 Pd 0.02202476 5.15776343 12.06280342 2.15852406 0.61722891 -1.54365004 Pd 3.44779419 3.45176257 10.29571903 -2.86930797 -2.17706637 -0.48837334 Pd 5.17414545 5.17228147 10.32991327 3.95046870 -1.65576430 0.42327387 H 5.15008630 3.41754887 12.06752929 -0.76985042 -0.21811353 -0.88586030 Pd 3.41641032 5.18235045 12.01137712 -2.65694771 -1.19146845 2.36285617 Pd 6.88734821 3.46847234 10.36576047 -1.25639947 0.72524140 0.02539566 Pd 8.62436326 5.13093216 10.31154319 -0.55581929 1.11149773 -2.07994907 Pd 8.61276139 3.43832607 12.03651987 -0.30492568 -0.04997398 2.15843381 H 6.85060368 5.14401090 12.04232881 0.05875950 -0.19643616 -0.66266746 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-0.97584033 H 6.86665391 10.34433558 10.31168321 -0.14688310 0.06865536 -0.01737435 H 8.61658022 12.05119246 10.31930566 0.46085540 -0.75483047 -0.35274070 Pd 8.60932273 10.29618716 12.01130977 -0.76127500 0.64404092 -2.30114072 H 6.91282269 12.06739816 12.04114640 -0.04411253 -0.59940358 -0.49472363 H 10.30603387 10.30462706 10.31880456 -0.42502763 0.33867284 0.22054892 Pd 12.04643198 12.04708011 10.32831227 -1.38461937 -1.94508839 0.33979528 H 12.07196063 10.31099142 12.00802422 -0.61769598 0.05141356 -0.56604009 H 10.33630833 12.06068411 12.01981327 0.02720428 -0.59814935 -0.61927501