108 Lattice="10.992997700838629 0.0 0.0 0.0 10.992997700838629 0.0 0.0 0.0 10.992997700838629" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-228.51800546831527 pbc="F F F" Pd 0.03447638 -0.03179716 -0.00636853 46 0.83523577 1.65590158 0.86578330 H 1.78607364 1.80744585 -0.03651040 1 -0.33073771 -0.04867226 0.65920516 Ag 1.88636798 0.00394641 1.81989643 47 -0.33734661 1.64595251 1.46415391 H -0.01449893 1.85803429 1.79774846 1 0.55654446 -0.12380982 -0.10160145 Ag 3.65696486 0.01719272 0.02702583 47 -0.76223926 0.61322453 -1.44141887 Pd 5.50800714 1.82534529 -0.01995830 46 -0.29661423 0.40646692 -0.93619438 Ag 5.45046376 0.03258861 1.80236280 47 0.23597053 -0.82844090 1.76985857 H 3.61491154 1.82759833 1.84665363 1 0.25376967 -0.15492676 -0.62330148 Pd 7.34393914 0.04862493 -0.00568282 46 0.04964422 0.17707739 -0.09543108 Pd 9.18028223 1.86540988 0.01571681 46 -0.56956425 0.70162651 0.94630831 Ag 9.14003149 -0.02711311 1.84875653 47 -0.50917939 0.63237023 1.06312719 Pd 7.31172035 1.84812055 1.84499070 46 1.77369959 0.60055056 1.40818562 Pd 0.00057080 3.68025903 0.01968716 46 2.42935959 -0.89463711 1.80586190 H 1.84950097 5.50124437 -0.02289811 1 -0.45841666 -0.42784590 0.64360472 H 1.79987896 3.65011263 1.86307757 1 -0.47064453 0.17041405 -0.37651496 Ag 0.03252955 5.49816884 1.88219982 47 -0.53559180 -0.62754473 -0.11362101 Pd 3.63873855 3.62909194 0.03070526 46 -2.11023618 -0.74693301 0.83889812 Pd 5.46439720 5.52311954 0.02055372 46 0.41602331 0.78079461 -0.59315506 Ag 5.48054208 3.68250694 1.82172534 47 1.34348753 -0.70583264 -0.60060915 Pd 3.69894570 5.53336853 1.81059086 46 -1.91933682 -0.24145792 -1.87081151 Pd 7.35931682 3.69383314 0.01671281 46 0.46568402 0.51246475 0.44853481 Ag 9.16428908 5.53063677 -0.02539961 47 -0.31052409 -0.72707844 0.41843085 H 9.13239134 3.69671486 1.85649829 1 -0.70312340 -0.28934838 -0.80630302 H 7.31529727 5.50490114 1.84206772 1 0.14864665 0.30229242 -0.89711061 Ag 0.02465324 7.32803908 0.01128983 47 -0.49427926 -0.50038631 -0.36484925 Ag 1.86711977 9.10796699 0.05382679 47 0.75462942 0.62183630 -0.34199256 Pd 1.81890278 7.34714191 1.84082804 46 -0.50771670 -0.22645370 -0.61926511 H -0.00437104 9.14971660 1.86259113 1 0.91053351 -0.66962256 -0.09763241 H 3.67257969 7.31429378 -0.00031460 1 0.39580174 0.41849489 0.76158899 Pd 5.50882507 9.16514051 -0.00706731 46 0.19105313 -1.04985379 1.10510064 Pd 5.48009762 7.32179909 1.86414114 46 1.35580543 0.44580738 -1.88272975 Pd 3.70927586 9.16260214 1.85177350 46 -0.04864321 0.95439930 -1.02669817 Pd 7.29390551 7.37455073 0.00468959 46 -0.10630621 -0.01194133 0.72602151 Pd 9.13932983 9.16229254 0.02820787 46 -1.20829495 -0.32975072 0.99857940 Ag 9.19429692 7.34500100 1.86731032 47 0.64720636 0.80853163 -1.21291436 H 7.29624455 9.18348684 1.84166397 1 0.37405406 -0.85490186 -0.68282214 Pd -0.00265541 0.01438232 3.64458153 46 0.92363430 1.42663062 -0.82885581 H 1.80668914 1.82586995 3.62269619 1 -0.81480942 -0.46200096 0.23805782 Pd 1.86273713 -0.01540199 5.50638000 46 0.49849135 -0.94908465 -1.75420277 Ag 0.00388580 1.79632576 5.47320083 47 -0.67626278 1.02065267 -1.47003732 H 3.62284753 0.02169867 3.73001092 1 -0.13986132 0.46863108 0.03233347 Pd 5.50475616 1.83980965 3.67154845 46 1.02722237 -0.96714961 -0.25645548 Ag 5.48592622 -0.03354822 5.49672289 47 1.11370183 -0.54742276 -1.44349499 Ag 3.68807135 1.89022737 5.53859766 47 -1.16171676 0.14672399 -0.17163384 H 7.39089931 0.01203195 3.67922420 1 0.19524747 0.46459730 -0.22609025 H 9.18855615 1.78517225 3.70659894 1 -0.43116454 -0.33186860 -0.07518921 Ag 9.14950139 0.00394328 5.50553526 47 -0.54672274 1.57165278 -1.07915714 H 7.36840481 1.81223141 5.49455874 1 0.01197173 -0.21126334 0.26660034 Pd -0.03335083 3.65093498 3.68786533 46 1.43456051 -1.35837777 -0.67176225 Pd 1.83324834 5.48180566 3.63356591 46 -1.12298169 -0.96315436 0.20411600 H 1.81057449 3.60324361 5.54322145 1 -0.77008854 0.17936802 -0.10733861 Pd -0.03307124 5.49057170 5.50049191 46 1.06992721 0.78777481 0.37640142 Ag 3.68547253 3.65618938 3.69766599 47 -3.64175111 -1.95406320 -2.61353550 Ag 5.50158846 5.52028724 3.65119091 47 1.90982064 -0.65025403 -1.84394286 Ag 5.50644233 3.69860060 5.51077278 47 1.52507020 -3.12036539 0.81692423 Ag 3.65736702 5.44214779 5.46997949 47 -2.89870004 0.50030276 3.74524529 H 7.37188962 3.68634405 3.70260854 1 -0.04906671 -0.20500433 -0.02927372 Ag 9.13277888 5.50004355 3.67391370 47 1.62974579 -2.14918076 -2.19000994 Ag 9.13551661 3.66807639 5.48322745 47 0.94665358 -2.31791819 0.10024342 Ag 7.30909213 5.51107821 5.49874211 47 1.64047780 -0.23233652 0.80769226 H 0.00936259 7.31600263 3.65256010 1 0.86497373 -0.10012096 0.44901501 Pd 1.82954624 9.14102258 3.60637932 46 -1.28515810 0.67799282 -0.24020531 Pd 1.86251847 7.29823017 5.46529187 46 -1.18996652 -0.21856549 1.72097743 Ag 0.00314630 9.14852571 5.44893363 47 -0.27919813 -0.90658428 -0.00061059 Ag 3.64625588 7.31926222 3.66094986 47 -0.72832337 0.93115944 -0.14399727 Ag 5.52969892 9.14618464 3.62150308 47 1.32701562 2.60786992 0.30463708 Pd 5.53812302 7.29989002 5.46501802 46 -0.64767137 1.87157214 1.25583856 Pd 3.64038187 9.13458887 5.51806161 46 0.05947654 0.52913887 0.83342175 Ag 7.37606513 7.29797929 3.65773741 47 -0.34381046 2.43186637 -1.29977672 Pd 9.13986809 9.17538362 3.66662245 46 -1.42521056 0.08630700 0.03448601 Pd 9.15370377 7.30622389 5.50699899 46 1.21857566 0.54311720 0.94935254 H 7.34915073 9.16841415 5.50188679 1 0.45964505 -0.74127122 0.14598937 Ag 0.00946683 -0.03455923 7.31607404 47 -0.82275240 -0.72740776 1.00580644 Ag 1.84524862 1.84830575 7.30228072 47 0.10959915 2.09264269 1.82962846 Pd 1.82058446 0.00606598 9.18301577 46 -0.30097700 0.75936244 -0.09559707 H -0.01332531 1.82483455 9.17644507 1 0.89531685 -0.36124967 -0.86654214 Ag 3.69119460 0.02051413 7.31791700 47 0.97103473 -1.63998643 1.99258334 H 5.50956430 1.78205486 7.31329634 1 -0.23544812 0.21544953 0.39487425 H 5.51490097 -0.01365715 9.12607062 1 -0.24869860 0.74353732 -0.64154362 Pd 3.66374689 1.80462778 9.18528028 46 0.68143159 0.90612659 -0.96472987 Ag 7.31144458 0.03029320 7.32322671 47 -0.62152130 1.32740378 1.27183611 H 9.14250494 1.80107939 7.29288591 1 -0.55125637 -0.65013231 0.01286569 Ag 9.16301389 0.00935391 9.18501924 47 -0.67343418 1.49709149 -0.68561751 H 7.33782523 1.84150921 9.14176386 1 0.01739193 -0.18019275 -0.61980851 Ag 0.02490184 3.68194883 7.36489714 47 0.37239306 1.17829073 0.96610905 H 1.83359290 5.48733245 7.36364180 1 -0.29642995 -0.08932133 -0.56372059 H 1.82896127 3.66965949 9.13096767 1 0.27324124 -0.57334748 -0.60650294 H 0.04359149 5.49724365 9.13073795 1 0.28061416 -0.17498473 -0.55152014 H 3.64283111 3.66779596 7.34075581 1 0.40468750 -0.49352276 0.55457331 Ag 5.50842075 5.48256807 7.34718792 47 -2.04223394 0.95887946 2.74895785 Pd 5.46404799 3.66726724 9.16364658 46 -0.38173533 -0.32851671 -0.94634222 H 3.69291296 5.47367838 9.16987047 1 0.51489157 -0.22337588 -0.40138805 Ag 7.33551572 3.68022793 7.34765963 47 1.67415260 -2.34898401 2.65087966 H 9.12751612 5.53286750 7.34605631 1 -0.54904283 0.64374667 -0.00975366 H 9.17432838 3.68389442 9.16224319 1 -0.50260448 -0.10971544 -0.49774248 H 7.34183441 5.51862489 9.14379115 1 -0.11768577 0.39067355 -0.53543830 H 0.00167125 7.35794955 7.29732847 1 0.87753894 0.17108839 -0.80149743 Pd 1.79343580 9.18484033 7.29981747 46 -0.16335657 -1.61660692 0.91624269 H 1.83111392 7.34270183 9.12496059 1 0.44593359 0.50075711 -0.74338098 H 0.01055058 9.16824178 9.18794368 1 0.70357052 -0.27929942 -0.71470280 H 3.72246882 7.32505278 7.28383764 1 -0.04582652 0.91253318 -0.04289588 Pd 5.50933731 9.15262314 7.30680619 46 0.01196926 0.40260170 -0.77306329 Ag 5.45394031 7.36329529 9.17900342 47 0.21862539 -1.56705492 0.93535106 Ag 3.66915466 9.12867933 9.18584906 47 -1.48095835 0.06237541 -0.48907941 Pd 7.35602431 7.37317856 7.30040299 46 0.52318654 -0.54100854 0.59048391 Ag 9.13428120 9.13847460 7.34654277 47 0.22126411 0.77699998 -0.64512582 Pd 9.16847223 7.32925137 9.15508625 46 -1.15875368 -1.59052738 -0.96824062 Pd 7.35621094 9.11540124 9.14221000 46 -0.16622837 0.10753560 0.22001243