864 Lattice="22.40987765206814 0.0 0.0 0.0 22.40987765206814 0.0 0.0 0.0 22.40987765206814" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2121.047969860688 pbc="F F F" Ag -0.03200229 -0.02823359 -0.02492624 47 0.63575298 1.43860036 0.59661774 H 1.81056266 1.80420659 -0.01856565 1 -0.13164967 -0.18756269 0.71610807 Ag 1.83195413 -0.03293942 1.82387279 47 -1.09431421 0.01776015 0.24062637 H -0.01896378 1.80089110 1.87528287 1 0.65628834 0.02403724 -0.45401401 Ag 3.72686589 -0.02807159 -0.00212196 47 -0.53492073 0.06616188 -1.00929734 Pd 5.58372868 1.85771045 -0.02382868 46 0.28153583 -0.60677504 -1.09947416 Ag 5.60961483 0.03374056 1.85851835 47 0.75855420 -1.00109582 0.87407278 Pd 3.69838302 1.88395334 1.86935286 46 0.26679043 0.26877325 0.28257965 H 7.46492718 0.03020116 0.03501513 1 0.01396541 0.73305695 0.66735285 Ag 9.30113086 1.83129363 -0.02534668 47 1.14511124 -0.09428144 -0.22331699 Ag 9.32378492 -0.02246251 1.92223399 47 0.03057078 -0.83144443 -0.34026849 Ag 7.45113720 1.87133881 1.87291315 47 0.31957336 -1.07400261 0.43170436 Pd 11.19581200 -0.02502431 0.02419539 46 0.94719141 1.20539904 1.64807965 Pd 13.08950618 1.88012171 -0.01516391 46 -0.26858003 0.72478824 1.96477048 H 13.04565021 -0.02648404 1.83340936 1 -0.32605133 0.98209318 -0.66772547 H 11.20720078 1.89786109 1.89657335 1 -0.13138117 -0.45530031 -0.57400401 Ag 14.93812770 -0.01071209 0.00899216 47 0.34867701 0.83355292 1.19351054 H 16.81368913 1.84651130 0.02666017 1 0.25587800 -0.57179850 0.63806088 H 16.78880134 0.02815403 1.83168088 1 0.09224630 0.72389209 -0.56053314 Pd 14.94902813 1.90351072 1.88495285 46 0.19667468 -0.03851635 -1.24125675 Pd 18.67088958 0.00140418 -0.01848851 46 -1.08090730 1.11567954 1.09382571 Pd 20.52689991 1.89703537 0.02086874 46 0.12658342 -0.46140681 -0.09442954 Pd 20.56975123 0.01764346 1.86144439 46 -1.07523815 1.01227146 1.00691914 Ag 18.69378372 1.84989864 1.84985897 47 -1.18243263 -0.71726986 1.44988912 Ag 0.01022820 3.72358335 -0.01325598 47 -0.44603413 -1.67580587 -0.37417442 Ag 1.86238509 5.58031650 -0.01796463 47 1.40865418 0.90963935 -0.44273194 Ag 1.87275692 3.71697359 1.87365495 47 1.24997043 0.15900973 0.33726393 Ag -0.01034109 5.61642937 1.86569678 47 -0.26081391 1.27083602 1.62061178 Pd 3.74510639 3.69924652 -0.03162272 46 -0.06870142 0.57768728 -0.05849512 H 5.59962248 5.59094988 -0.00543509 1 -0.06561959 0.24419338 0.57388598 Ag 5.58791402 3.75657015 1.83868917 47 -1.67425460 2.11281501 1.18552872 H 3.74314291 5.53974321 1.83945373 1 -0.12182344 0.20747945 -0.46743924 Ag 7.43367252 3.69807080 0.02080664 47 0.38578820 2.05694947 -1.06248097 Pd 9.32411593 5.53135970 0.00397971 46 -0.52411502 0.10691879 1.65299560 H 9.28647417 3.73465222 1.88503910 1 0.15260653 -0.02504907 -0.60956704 H 7.45496959 5.60377161 1.83453482 1 0.14342272 0.13763248 -0.47273051 Pd 11.20244934 3.72145102 0.01250563 46 0.12516998 -0.85731884 1.61416350 Pd 13.06138222 5.57808523 0.02967395 46 0.48790821 -1.21559385 -0.25234062 H 13.10732990 3.72014523 1.87282260 1 -0.13076511 -0.40857541 -0.69661869 Ag 11.20949625 5.61795608 1.89622619 47 -0.57689012 -0.84407204 -1.07659772 H 14.95934229 3.67458411 -0.00596118 1 -0.32755868 -0.22111088 0.60980629 Pd 16.80170321 5.56904236 -0.00490423 46 0.19854845 -1.04452493 0.69690208 H 16.81622098 3.70110494 1.87511279 1 0.06439838 -0.15135357 -0.19654101 Ag 14.93027123 5.58838941 1.90867558 47 -0.07974100 -1.36227182 -0.41327659 Ag 18.70553765 3.70370149 0.02635241 47 -1.77466498 0.38669463 -0.57992832 Ag 20.57566861 5.63728379 0.02796192 47 0.16473552 0.65992411 0.41507711 Ag 20.57226679 3.73565720 1.84766869 47 0.36715837 -0.19857070 1.89352132 H 18.66354277 5.63605898 1.85246909 1 0.25718511 -0.06514332 -0.22864043 Ag -0.01231420 7.48074729 0.03296108 47 -0.19772194 0.60544146 -0.34088397 Ag 1.86623452 9.37930971 -0.00405738 47 1.11508267 0.19768301 0.18720279 H 1.83266914 7.51149518 1.86613802 1 -0.15406541 0.19730031 -0.47314283 Pd 0.00058028 9.30345330 1.88276592 46 0.24220310 -0.33512075 1.02536266 Pd 3.69880456 7.45156785 0.01835885 46 -0.17065025 -0.47364019 1.31883067 Ag 5.61000358 9.30542612 -0.02241998 47 -0.69406384 0.57683902 -0.48913032 Ag 5.67095942 7.45733708 1.81708960 47 -0.39598832 -1.00916355 0.64979808 H 3.76309145 9.37035725 1.80906769 1 -0.11582826 -0.26713141 -0.19097114 Pd 7.47365010 7.48822627 -0.00629073 46 1.27419658 -0.08288546 1.56639776 H 9.30275778 9.29659592 -0.00185765 1 -0.24667506 -0.32644109 0.49593041 H 9.30416605 7.49213985 1.88029714 1 -0.08983656 -0.20548413 -0.49557940 H 7.50364726 9.32718321 1.82586777 1 -0.20014725 -0.02132797 -0.23145332 Pd 11.19271035 7.47680739 0.01160867 46 -1.31970584 0.19418509 -0.25023520 Ag 13.07010031 9.35055825 -0.03707455 47 -0.42408957 0.73607340 -1.36741412 Pd 13.06389445 7.44924137 1.88252247 46 0.84849030 0.68341327 0.77171579 Ag 11.22724261 9.31090097 1.86758467 47 -0.96358398 0.27666718 -0.35540544 Ag 14.98297251 7.47388428 0.02522828 47 -0.13449434 -0.35759604 -1.62816301 Pd 16.77637034 9.31190297 -0.03259010 46 0.08609120 0.81961469 -0.41924761 Pd 16.80323814 7.49134254 1.91341573 46 0.13826335 -0.95104289 0.04512813 Pd 14.96044569 9.31676022 1.83120169 46 -0.19569699 0.80858400 1.81091761 Ag 18.70512345 7.48274533 0.01851983 47 0.51857987 -0.02109590 0.15331518 H 20.54208858 9.29148822 -0.01794174 1 -0.71553845 0.08941233 0.56322586 H 20.57241744 7.49991992 1.90231264 1 -0.71896918 -0.43427392 0.02459010 Pd 18.64914944 9.35698213 1.83494485 46 0.98902059 0.47151929 0.83513117 Pd -0.03248496 11.18836654 0.01152384 46 0.80732990 0.58325503 0.56977382 H 1.86151452 13.07444528 -0.01272717 1 -0.79292897 0.03197401 0.93139651 Pd 1.86442988 11.18980387 1.87991190 46 0.15039477 0.08545761 -1.10770834 Pd 0.02249484 13.05504294 1.82899579 46 1.13266561 0.41671363 0.30660755 H 3.72848312 11.21999022 -0.02119749 1 0.08075783 -0.03922122 0.66671445 Pd 5.62643310 13.06503173 -0.01096252 46 0.08579953 -0.23472159 -0.21338787 Ag 5.57996863 11.18842336 1.88178563 47 0.35234315 -0.63785398 0.55152412 Ag 3.71571365 13.09711725 1.83074238 47 -0.81694561 -0.10276597 -0.39140587 Ag 7.46336757 11.22226682 0.06236198 47 1.66689298 0.08962450 -0.34557603 H 9.32694317 13.03895730 -0.00011157 1 -0.02747983 0.42569194 0.65002754 Pd 9.31123409 11.22794935 1.88698267 46 0.23649441 0.50399549 -1.87767630 H 7.46438571 13.10282029 1.83275222 1 -0.14165693 0.01302814 -0.42019538 H 11.17344333 11.25752880 0.01934813 1 0.42164100 0.10355127 0.67645633 Pd 13.03846550 13.08030492 0.03603388 46 -0.79196431 -0.46809081 1.06853311 Pd 13.12459181 11.22253076 1.84559385 46 -0.11161973 0.74975948 0.68067378 H 11.21071837 13.08810456 1.83285898 1 0.37364844 0.31078807 -0.37259331 Pd 14.92233457 11.23831992 0.02497648 46 0.72130611 0.66992080 0.64945880 Ag 16.83124336 13.04136086 -0.00263026 47 -1.11534454 0.20350381 0.52235592 H 16.79745160 11.23490831 1.87790685 1 0.06016396 -0.20385531 -0.49222363 H 14.92280440 13.01515069 1.88317604 1 -0.41345689 -0.02992222 -0.73072172 Ag 18.69920674 11.18866622 -0.00823737 47 -0.65249502 -1.37565442 -1.01546273 Ag 20.52325823 13.04042432 -0.02489138 47 1.23962990 0.55643293 -1.23887628 Ag 20.55061373 11.22371298 1.89752882 47 1.07505617 -2.28815780 0.52528192 Ag 18.69273971 13.08949649 1.91742062 47 -2.09573851 -0.83232526 -0.40866303 Ag 0.03492034 14.93244036 -0.03350172 47 1.06755045 -0.15631246 1.21787036 Pd 1.87478410 16.75129408 -0.00705634 46 0.37415215 0.27436315 1.63745233 H 1.90582275 14.97329525 1.84366396 1 -0.28284470 -0.07131678 -0.58328525 H -0.03173374 16.77711563 1.88026370 1 0.83724739 0.37474683 -0.67313523 Ag 3.69934532 14.96158344 -0.00295827 47 -1.49595649 -0.10977706 -0.39728730 Ag 5.58518434 16.79426857 0.00414565 47 -1.22065636 0.80275618 -1.70897805 Ag 5.61514761 14.95996036 1.90476825 47 0.55603168 -0.51680428 2.11698646 H 3.73882000 16.77641444 1.87185959 1 -0.13642555 0.07192605 -0.29631225 Pd 7.46774881 14.96372876 0.04300241 46 1.29247139 -0.98294556 -0.18250676 H 9.35861823 16.83831026 0.02559895 1 -0.12589198 -0.39907650 0.55645662 Pd 9.31095260 14.96970592 1.89811442 46 0.04711662 -0.90482768 -0.97310964 Ag 7.45440289 16.84063199 1.83557789 47 1.21914124 -0.98203548 1.25893205 Pd 11.17464662 14.96587152 -0.03543740 46 -0.48712009 0.48233563 1.80701412 H 13.07564051 16.81522265 0.02333095 1 0.10207890 -0.54982227 0.49959865 Pd 13.09623162 14.93441564 1.83316258 46 -0.89569244 -0.07696847 -0.79789640 H 11.21129999 16.83910043 1.79742264 1 -0.23316727 -0.45159632 0.02113342 Ag 14.96843936 14.96642992 -0.03115348 47 0.19598140 0.37550278 0.15181873 H 16.83879292 16.85163782 -0.02007502 1 -0.16005899 -0.06511604 0.51530003 H 16.80625451 14.92001230 1.84470634 1 0.08960246 -0.08294266 -0.20812369 Pd 15.00397184 16.82724096 1.86477344 46 -0.25220984 -0.49152373 -1.15231594 Pd 18.70647077 14.98173187 -0.03599635 46 -1.56277207 0.15565392 -0.49292679 Ag 20.49548898 16.77731472 -0.02754559 47 0.49215602 1.72515243 -0.57815179 Ag 20.51174870 14.95023880 1.86622495 47 2.42185668 0.34171334 0.06587858 Ag 18.68584649 16.82227401 1.84075113 47 -1.21521621 1.36216704 -0.50610983 Pd -0.00312712 18.66464904 0.01393488 46 0.47570963 -0.37013141 1.31153021 Ag 1.87023534 20.52699891 0.01530694 47 0.67187407 -0.30321196 0.61905721 Ag 1.85910548 18.67920028 1.86192285 47 0.82671335 -0.58878233 0.40190900 H 0.01331570 20.53912458 1.85462120 1 0.80869055 -1.11441996 -0.48051401 H 3.75738171 18.65435432 0.00039059 1 -0.16193548 0.22941966 0.56794380 Pd 5.59184949 20.56167445 0.01167421 46 -0.50524611 -0.95118844 1.64141632 Ag 5.61439783 18.64342951 1.85027742 47 -1.90941711 1.01955043 0.60565426 H 3.70666401 20.53850314 1.83903314 1 0.16169229 -0.79102310 -0.26941010 Ag 7.48984959 18.71881980 -0.03158539 47 0.25333807 -0.06653557 -1.04660189 Ag 9.31893152 20.53593162 -0.02061082 47 0.41973992 0.34423452 0.34411669 Pd 9.34803070 18.66426560 1.87235946 46 0.56151051 -0.46013422 -1.15632125 H 7.44628462 20.52268496 1.84991791 1 -0.00025131 -0.75620925 -0.17839157 H 11.21689643 18.64413892 -0.01048788 1 -0.33576870 0.38171859 0.59955648 H 13.09854203 20.53453228 0.00757950 1 0.14132325 -0.50988749 0.65511902 H 13.12116628 18.62821657 1.84810608 1 0.14569785 0.32906860 0.14050433 Ag 11.22966512 20.49986043 1.90016524 47 0.42816967 0.02813026 -1.52562480 Ag 14.92910831 18.65293876 0.03573119 47 -1.22346654 -0.96838277 -0.89124463 Ag 16.83263512 20.53570273 -0.02055135 47 1.43201554 -0.11513056 0.07862038 Pd 16.80065887 18.71384396 1.89140987 46 1.79263029 0.07126220 -0.99948365 Ag 14.93569227 20.53720964 1.86096752 47 -0.84164735 1.22293749 -0.42027288 H 18.65073639 18.62551271 -0.01441407 1 0.08657279 0.19347319 0.53384563 Pd 20.55122387 20.55484792 -0.01947755 46 -1.02246608 -0.96098206 1.10774354 H 20.51956577 18.63012678 1.89126225 1 -0.54901078 -0.06039792 0.38569341 H 18.65213895 20.52766360 1.86405250 1 -0.10952356 -0.63687511 0.40237005 H 0.01753586 0.01620204 3.68381380 1 0.79294023 0.47602153 0.10635216 Ag 1.85964382 1.86059027 3.73981527 47 -1.25345678 0.20648271 0.68640033 Pd 1.86342390 -0.00300703 5.55699904 46 -1.20501876 -0.36646972 -0.16599082 H 0.00543871 1.87593015 5.61216042 1 0.81655356 -0.39784901 0.29059343 Pd 3.71067814 -0.00814072 3.68616993 46 0.76135260 -0.56899630 0.07478148 H 5.59281443 1.82743853 3.71444293 1 -0.23005778 -0.10788199 -0.12221436 Ag 5.63660787 -0.00349985 5.58167843 47 1.48396873 -0.03504242 -1.04913779 Ag 3.72318390 1.84850678 5.57680838 47 0.51142017 1.27400362 -1.17136093 H 7.46419431 0.03154899 3.68714445 1 0.05598851 0.49199637 -0.14787128 Ag 9.34199588 1.90208313 3.74814575 47 0.90406251 -1.28835303 0.63955844 H 9.36843793 -0.01289253 5.62169365 1 0.20876271 0.50864480 0.06936933 H 7.42893333 1.82871382 5.61027311 1 -0.18479094 -0.07764964 0.23401599 Pd 11.18533829 -0.00216635 3.70659224 46 0.86620031 1.03009165 0.37438593 Ag 13.04234257 1.89617383 3.73778438 47 -0.73742828 -1.61277604 -0.84591564 H 13.09908678 -0.01552252 5.57220097 1 -0.37665324 0.53256312 -0.06137690 H 11.19529149 1.90146843 5.61912407 1 -0.05078189 -0.43494906 -0.12675380 H 14.97814547 0.02035178 3.71305827 1 0.30146676 0.80698686 0.13143441 Ag 16.79471386 1.85229606 3.73932909 47 0.98001545 -0.86981529 -1.27581217 Pd 16.77863796 0.01785959 5.57525429 46 -0.14532682 0.72757060 0.75763715 Pd 14.95002799 1.89774725 5.57411930 46 -0.04098928 -2.02069209 1.08385110 H 18.68072020 0.02862220 3.74063891 1 0.27434735 0.69452404 0.22195470 H 20.51021129 1.87644425 3.79633930 1 -0.66940736 -0.35166206 -0.05108529 Ag 20.51863599 0.01247013 5.58118988 47 -1.26409014 1.23900326 -0.07240735 Pd 18.64407068 1.89194905 5.65216390 46 0.58980961 -0.86185096 0.05388079 Ag -0.01473320 3.71302076 3.72473234 47 -0.46613229 -0.97035262 0.62699914 H 1.90307601 5.55837202 3.71623860 1 -0.32709173 0.03383906 -0.11681806 H 1.90642675 3.71137626 5.55821548 1 -0.23828073 0.06196698 0.15625777 Ag -0.00056640 5.53560298 5.57464033 47 0.72037202 0.38840422 -0.26747591 H 3.71788313 3.74339476 3.77805583 1 0.01665877 -0.23362789 -0.21013319 H 5.56996368 5.59999984 3.69901204 1 0.12240946 0.24935813 0.04490914 Ag 5.59087542 3.76787126 5.63589198 47 0.00762992 1.36230616 -1.07149084 H 3.68864874 5.62333892 5.62981867 1 0.13055934 0.30377680 0.24641134 Ag 7.43777268 3.70008222 3.70116518 47 -0.97075317 1.33440591 0.62139010 Ag 9.30978672 5.59822116 3.70836572 47 -1.26282964 0.38956567 -1.45727649 Ag 9.34270257 3.75078288 5.58470740 47 -0.75947881 -1.45915856 1.70742582 H 7.51089929 5.65295590 5.56641635 1 -0.22597827 0.08526411 -0.01524929 Pd 11.23647181 3.75713987 3.74571008 46 0.08106774 -1.43947479 -1.70367564 Pd 13.07147807 5.62246989 3.76966845 46 0.97650366 -0.07128003 -0.93645522 Pd 13.10347025 3.77230171 5.60573452 46 -0.63991995 -0.85438442 0.00155911 Pd 11.24395314 5.58311137 5.57627072 46 -0.45516288 -0.01300271 0.49559731 Pd 14.94200128 3.70266737 3.70240186 46 -0.08768337 0.38162623 -1.26794819 Pd 16.80000498 5.61974916 3.75888078 46 1.58716960 -0.85062051 -1.13355657 Ag 16.83020693 3.78002581 5.59123833 47 1.56251088 -0.17813254 0.23941323 Pd 14.97597649 5.62051913 5.56937277 46 -0.42423908 0.34960412 -0.32870302 H 18.66916069 3.75285250 3.74737666 1 0.49367244 -0.05037563 -0.06061855 Pd 20.51889170 5.59429718 3.71707358 46 -1.49915549 -0.04569879 -0.37415539 Ag 20.51918246 3.75454408 5.63426812 47 -0.13221619 -0.29997324 -0.82320802 H 18.65601485 5.66428007 5.56286833 1 0.85577279 0.10326556 -0.07157586 H -0.02945177 7.51563059 3.75497296 1 0.60887121 -0.06394497 -0.30325479 Ag 1.88983559 9.35907719 3.72392941 47 -1.00326879 -1.23195345 0.55200775 H 1.85359909 7.45500335 5.66315805 1 0.02228942 -0.09488177 0.21273997 H -0.01714828 9.32863759 5.59986358 1 0.71419969 0.13327948 0.40830666 Ag 3.75600997 7.50372106 3.73999949 47 -0.33072461 -0.70480164 -0.03692451 H 5.59869201 9.29898677 3.77206968 1 -0.06329411 -0.10938417 -0.12436875 Pd 5.59262835 7.41767321 5.63173773 46 0.05381468 -0.04638075 0.09014289 H 3.75737726 9.37928350 5.61479394 1 -0.06308151 -0.12104622 0.07913366 Ag 7.44549456 7.51108150 3.74143551 47 -0.50497731 0.24673098 -0.28145439 Pd 9.37083476 9.29992088 3.74990539 46 -0.77967359 0.22024817 0.54578147 Pd 9.33266753 7.45170160 5.63786130 46 -0.49353246 0.46933203 -0.56691441 H 7.45783658 9.38574729 5.60318592 1 -0.08406968 -0.03775895 -0.08177769 Pd 11.21684958 7.45282039 3.77470402 46 0.02230466 1.51440759 -0.20069638 H 13.04516783 9.36353933 3.77462825 1 -0.07403146 0.22229354 -0.22905860 Ag 13.06569180 7.46966532 5.63015444 47 0.57949532 1.91557571 -2.20653626 H 11.16013032 9.35618576 5.64303286 1 -0.04040443 0.02598162 -0.02498531 H 14.89943866 7.47785099 3.75369730 1 0.27721581 -0.02282013 -0.28043960 Ag 16.81445525 9.34686068 3.76047761 47 -0.82262176 2.51186357 0.81949036 Ag 16.78989898 7.45866792 5.56501291 47 0.79168297 0.61019229 0.74019172 H 14.91678863 9.27227345 5.57602042 1 0.07242443 0.29212074 0.28479889 Ag 18.69493478 7.45943076 3.79017496 47 1.83915232 -0.02626022 -0.36456683 H 20.57742276 9.29700798 3.73217656 1 -0.61069482 -0.09739607 0.32997981 Pd 20.56111532 7.49252119 5.59784342 46 -1.81436052 0.55595200 0.32800363 H 18.65820627 9.26674306 5.60120955 1 0.56448101 -0.10979460 0.14869719 H 0.03690138 11.22223535 3.75292565 1 0.81367105 0.04283342 -0.63087956 Ag 1.85141187 13.07193851 3.73709153 47 -1.59440864 0.80919354 0.54033112 Pd 1.90445957 11.21092858 5.60753440 46 -0.76481228 -0.11018783 -0.59752976 H 0.01495118 13.09321865 5.63924916 1 0.83377536 -0.12131390 0.18474317 Ag 3.76418845 11.23736546 3.75406779 47 1.16387382 -0.61443630 1.00856303 H 5.59459490 13.07044243 3.76683229 1 0.02449216 -0.03836876 -0.04954363 Pd 5.63640726 11.22196777 5.58086490 46 -0.72930597 -1.19985048 -0.52630089 H 3.77156322 13.07432478 5.57689966 1 -0.17235834 0.04244994 0.01671888 Pd 7.45602350 11.23065209 3.71418498 46 -0.65329738 -0.72518320 0.05978667 Ag 9.32037716 13.04429058 3.77104730 47 -1.68187874 0.33214532 -1.38679538 H 9.29070084 11.23073016 5.58058047 1 -0.22583420 -0.01785998 -0.10821093 Pd 7.50324184 13.06421987 5.61756782 46 0.36992948 0.10054115 -0.52129644 Ag 11.17586228 11.23566000 3.77701614 47 0.48957576 -1.72919045 -0.33423301 Ag 13.09623836 13.10093261 3.76125395 47 1.52873977 -1.37453097 -1.80762783 Pd 13.07133104 11.21364427 5.62664612 46 0.80985658 -1.42344927 -0.75081349 Ag 11.21532583 13.09796296 5.56594713 47 -2.29483644 -1.65695453 2.44464493 H 14.89969095 11.17189977 3.71432415 1 -0.14189161 0.06837663 -0.11753494 Ag 16.80216857 13.10418205 3.71049236 47 -2.00932821 -2.71650525 -1.16218141 H 16.83820574 11.20011885 5.57682551 1 0.12118250 0.02087836 0.12632381 H 14.93902113 13.07833204 5.57437239 1 -0.18961110 -0.08482100 0.03576293 H 18.71324368 11.19483008 3.76140120 1 0.21213809 -0.03397027 -0.24049274 Ag 20.57589617 13.04764732 3.71684873 47 1.62925894 0.62794712 1.10385804 Ag 20.53983081 11.23826512 5.57297942 47 0.17762050 -2.66085837 -0.77061551 Ag 18.65410036 13.10494645 5.56857960 47 0.42204117 -1.75383444 -0.38171617 H 0.02754632 14.95273114 3.70798105 1 0.63322134 -0.11962611 -0.04244410 H 1.89775012 16.78228699 3.71592708 1 -0.08754958 0.26281389 0.20650910 Pd 1.84160084 14.93564454 5.58729000 46 0.23701703 -0.09697425 -0.06726293 Ag 0.00265494 16.82337909 5.62174944 47 -1.21203382 -1.03339320 -0.34817502 Pd 3.75300956 14.92477859 3.76139518 46 -0.01903639 1.12517509 0.10804104 H 5.60541257 16.78644938 3.71669429 1 -0.17762500 0.15220872 -0.02617938 Pd 5.63772256 14.97652625 5.58097500 46 -1.21744373 -0.43149435 -1.44224641 H 3.68997421 16.76248126 5.59113855 1 -0.20915492 -0.03233483 -0.12150411 H 7.49935189 14.99658107 3.79187876 1 0.11544496 -0.03554977 -0.07012940 Pd 9.37076368 16.79118302 3.71743794 46 0.45408323 0.48006630 0.65552943 Pd 9.29635272 14.95355279 5.56897914 46 -0.05555825 -0.02210762 0.27875542 Ag 7.50640736 16.79274920 5.61782946 47 -0.53053060 1.17332285 -1.80208755 Ag 11.14884947 14.93277036 3.75182877 47 0.35501102 1.29909159 -1.91243979 Ag 13.03559324 16.84238390 3.71420060 47 -1.09613155 0.21311673 -0.49966448 Ag 13.03745886 14.95515031 5.62542233 47 1.75909431 2.64361979 1.49418324 H 11.17189045 16.82453541 5.65052605 1 0.00287297 0.01478050 -0.07697992 Ag 14.93703334 14.96574754 3.75896982 47 0.39390553 -0.13332945 -0.54811960 Pd 16.80668739 16.79684714 3.70937279 46 -0.18201267 -0.42715891 0.07329694 Ag 16.80384749 14.93406784 5.58874721 47 -2.28593009 1.01299252 0.78730784 H 14.93732385 16.82471228 5.57932061 1 -0.03786736 0.24812767 -0.00850002 Pd 18.71163083 14.90540291 3.74170400 46 0.15286650 0.96656120 0.07562335 Pd 20.52562188 16.77519375 3.73204108 46 0.43872863 0.87006882 0.78680899 H 20.50896509 14.88802886 5.56839158 1 -0.46610511 0.20786581 -0.11398903 Pd 18.65199503 16.80939661 5.62652238 46 1.40488174 0.98016604 0.36385212 Ag -0.02240645 18.64652619 3.72596227 47 0.20951389 0.57763044 -0.75847912 H 1.88807032 20.54471324 3.73328502 1 0.43395064 -1.02662638 0.18797380 Ag 1.88551656 18.66266179 5.66828913 47 0.79289939 1.51892128 -0.30880099 H 0.03064992 20.56108828 5.58737027 1 0.55409604 -0.78299888 -0.11406688 Pd 3.74485063 18.70825056 3.70005526 46 -0.24680245 -1.42352094 0.13870665 Ag 5.56822827 20.52241791 3.78739695 47 0.81046646 0.47335099 0.07722946 H 5.59048112 18.65453093 5.66048808 1 -0.21280080 0.35326280 -0.21564045 Pd 3.74768573 20.54891077 5.60624225 46 0.02603976 -1.29648339 1.34758940 Pd 7.49235372 18.65652727 3.73693843 46 -0.56438292 0.80224264 1.20799488 Pd 9.30149394 20.54731815 3.69998114 46 -1.06641183 -0.44283498 0.62909375 H 9.30616461 18.70509882 5.64952069 1 0.08285671 0.30766521 -0.26269229 H 7.44063502 20.55805445 5.59809855 1 0.02681697 -0.62595970 -0.45139748 Pd 11.23347841 18.68001295 3.73048837 46 -0.51450155 -0.99885761 0.24812884 Ag 13.07295942 20.56496532 3.71438432 47 0.39118138 0.91048765 0.87184430 Pd 13.09762845 18.63956851 5.60996459 46 0.22887518 -0.78053568 1.05385145 Pd 11.17359688 20.55441147 5.60060867 46 -1.39262365 -0.27688612 0.46469055 Ag 14.90639398 18.65625075 3.74686859 47 0.43179051 0.29376071 0.87793930 Pd 16.82236099 20.54115657 3.70885071 46 0.35370545 0.60048754 0.31846164 Pd 16.82762131 18.65532754 5.59975909 46 -0.35919320 0.43949747 0.56414919 H 14.94894511 20.51624418 5.58848503 1 0.21756476 -0.53714474 0.01906739 Pd 18.68261237 18.65866156 3.76168774 46 1.39151483 0.98982855 -0.47706357 Pd 20.53184404 20.56875385 3.74854336 46 -1.34007487 -1.67903060 -0.35655647 H 20.51942853 18.70482733 5.58966839 1 -0.87508753 0.26742990 -0.49949711 Pd 18.65198464 20.56496600 5.57208141 46 0.85599104 -1.38957587 0.97202689 Pd -0.03382000 0.00758227 7.42355139 46 1.04347662 0.89705266 -0.14315686 Ag 1.89264197 1.88656508 7.44045246 47 -1.97318441 0.92271594 0.26658865 H 1.87962070 -0.03300923 9.34738488 1 -0.35064159 0.79898895 0.04854774 Ag 0.00311995 1.84034044 9.30557637 47 -0.21144210 0.51378811 -0.57554963 Ag 3.72149420 -0.03619995 7.48772661 47 -0.71561740 -1.78071942 0.45073509 Pd 5.58398978 1.87567946 7.46052921 46 1.63178922 0.10003914 0.74068552 Ag 5.60364156 0.00060096 9.35757825 47 1.68238823 -0.58923061 0.66545929 Pd 3.72826514 1.86550068 9.34070372 46 -0.66452490 1.06418069 0.62750399 Pd 7.50027213 -0.01185301 7.52862024 46 1.23900785 1.90951843 -0.29182536 H 9.28311635 1.87672980 7.47113747 1 -0.03204578 -0.53366378 0.37779061 Pd 9.34997326 -0.02882948 9.33822761 46 -1.31161525 1.13888383 -0.10340734 H 7.40936506 1.83624549 9.32360951 1 0.12780856 -0.49025104 -0.36320689 Pd 11.22782826 0.02550473 7.49401357 46 -1.00291881 0.74891563 -1.74783790 Ag 13.03078236 1.88328035 7.45025986 47 0.18868414 -1.20280809 -1.55869136 Ag 13.10863564 0.01655732 9.30052875 47 0.63026357 -0.86838986 0.42831594 Pd 11.20591022 1.88129232 9.34323747 46 -0.07559453 0.01025105 0.76239900 H 14.92520406 0.00595561 7.44932705 1 0.43673880 0.51681753 0.14825325 H 16.75363962 1.83928922 7.48316043 1 0.08229602 -0.49399136 -0.03634666 Pd 16.79357950 0.02006929 9.35139948 46 1.28691250 1.34014045 -1.22273659 Pd 14.96007391 1.84475445 9.28608503 46 0.05501916 -0.08938249 -0.01275090 H 18.72194366 -0.00956352 7.48363633 1 0.06020827 0.52791502 -0.17563651 H 20.56484686 1.89010676 7.44861102 1 -0.65495909 -0.21395332 -0.17197165 Ag 20.54006042 0.02669151 9.37413379 47 -1.80357950 0.63102155 -1.06249916 H 18.68316804 1.82777361 9.32948194 1 0.02686462 -0.27108468 0.23119518 H 0.02760558 3.69000654 7.45608424 1 0.50239970 0.16369669 0.05762480 Ag 1.85268657 5.63348239 7.48640291 47 1.58647894 -0.95935421 -0.17564715 H 1.85040151 3.68118453 9.29920132 1 -0.33689221 -0.01262462 0.06229497 Ag -0.01501375 5.63916788 9.31052206 47 -0.47329868 -0.45143941 0.61028697 Pd 3.73717820 3.73353661 7.49493898 46 -0.09623392 1.91368273 0.88801566 H 5.62351657 5.60366313 7.47194188 1 -0.12368022 0.17200832 -0.21815370 H 5.56799169 3.75708509 9.33847500 1 -0.06707343 -0.18394874 -0.16442927 H 3.68136813 5.54945886 9.37703462 1 -0.19495785 0.32347737 -0.17901677 Pd 7.45952097 3.77090297 7.48003806 46 -0.47991450 -0.78243176 0.19291799 Pd 9.37107641 5.61296633 7.45555171 46 -0.19116999 -0.56823906 0.08014030 Pd 9.40141863 3.68191616 9.31740423 46 0.04844914 0.17444241 0.61046819 Pd 7.49120158 5.60874073 9.34518861 46 -1.00546690 -0.27932855 -0.34663845 Pd 11.21241154 3.73177862 7.50073512 46 -0.79599274 -0.51270082 -0.46350437 Ag 13.10080061 5.58020262 7.49313320 47 -0.97481229 0.60370166 0.95348872 Ag 13.03855945 3.79577097 9.35637351 47 -0.44111398 -0.20382202 3.31959716 H 11.17221587 5.61139738 9.32853079 1 -0.14746536 0.11354183 -0.01880886 Pd 14.93309147 3.70161497 7.46418469 46 1.08546752 -0.64020044 -0.03273514 Pd 16.81566973 5.63085304 7.48661201 46 1.45070146 0.40151351 -0.75111223 Pd 16.80144009 3.71163683 9.33399154 46 0.80530729 -1.43244844 0.47047156 Pd 14.93660757 5.58939230 9.31330285 46 -0.99554337 0.70469498 1.93839706 Pd 18.72512663 3.74768430 7.47707881 46 -0.34780127 -1.04889483 0.18785697 Pd 20.53661903 5.63935509 7.48856762 46 -0.51118626 1.04414694 -0.82693633 Ag 20.54925732 3.72779345 9.35696200 47 0.02486562 -1.20143731 -0.43029565 Ag 18.64220682 5.63951364 9.35773998 47 0.26857049 -0.51549503 -0.94521346 Ag -0.02279412 7.48612364 7.44170223 47 -0.47838148 0.95198775 -1.06674190 Ag 1.89137537 9.34762296 7.50034453 47 0.97264917 -1.39788083 -1.01946114 H 1.85279005 7.44731605 9.31298020 1 -0.13062422 -0.10124982 -0.31827574 Ag 0.02204917 9.34579621 9.36257080 47 -0.28999149 -1.42308996 1.07753686 Pd 3.74429330 7.44846601 7.48339994 46 0.60335772 0.10090093 0.68237783 H 5.63922825 9.30939195 7.48491802 1 -0.18317213 -0.13683136 -0.25169140 H 5.62914311 7.46266191 9.33271616 1 -0.13305937 -0.10194796 0.03158381 H 3.72804911 9.27382545 9.36332396 1 -0.13179091 0.02259258 -0.20574221 Ag 7.48515507 7.45961999 7.43118287 47 -2.35701675 0.45080804 0.06271988 Ag 9.33660985 9.36257400 7.46526948 47 0.60579487 2.18863549 -0.05985975 Pd 9.31903779 7.44725008 9.30639458 46 0.76652439 0.09452868 0.97259153 H 7.40891036 9.34609022 9.31755743 1 0.30319692 -0.01743244 -0.01559607 Ag 11.18575742 7.44118163 7.47716375 47 0.73358585 0.81916509 1.56773235 Ag 13.09465733 9.35594058 7.47242695 47 -2.05737614 0.90235624 0.90133338 H 13.03611618 7.46438365 9.32668102 1 -0.01305138 0.12325471 0.02915170 H 11.16719737 9.27483743 9.33966866 1 -0.12833905 -0.10775455 0.08404658 Ag 14.90471218 7.48567049 7.44169405 47 0.52481206 0.52622430 0.75563686 Pd 16.83535472 9.30171251 7.45716261 46 1.13556999 -0.17432586 -1.75535922 Pd 16.81614143 7.44912766 9.37155034 46 -0.11930889 1.10148494 0.35889887 Pd 14.95255139 9.32121996 9.30925481 46 -1.04517810 -0.03885685 2.85716661 H 18.65917129 7.48121789 7.44768582 1 0.74406002 0.13627240 0.00836582 Pd 20.52728370 9.30953455 7.51396407 46 -0.97218288 -0.31456204 -0.03666888 Pd 20.54536752 7.45842894 9.37296798 46 0.46134741 0.50170724 -1.02475216 Pd 18.66667220 9.32825935 9.35618674 46 0.30217354 -0.27408834 -0.10931645 Pd -0.01163454 11.23358779 7.45223540 46 -0.62138717 0.56459133 -0.55756217 Ag 1.89350941 13.05619951 7.46256040 47 -0.79930656 2.32021207 -0.59863618 Ag 1.89467913 11.23970742 9.35790889 47 -0.39334909 -0.40179446 1.57938496 H 0.01077229 13.07763472 9.31203627 1 0.55645720 -0.26784773 0.18923139 Pd 3.72252855 11.17345375 7.46577277 46 1.77553611 -1.14570596 -0.24801834 Pd 5.56534323 13.09552716 7.48636519 46 -1.22388769 0.85722985 0.28948653 H 5.57544286 11.24618542 9.34458535 1 -0.16992677 0.14010339 -0.00865726 Ag 3.72215378 13.05846307 9.34749292 47 0.44676530 1.87615769 0.11700885 Ag 7.43450326 11.23852274 7.49742198 47 0.53327866 -1.70347548 0.11767188 H 9.33825896 13.07040210 7.48272949 1 -0.15023800 0.12822887 -0.09248995 H 9.30312528 11.25001555 9.35525453 1 -0.02130729 -0.20391431 0.05250451 Ag 7.49371373 13.04680194 9.36402572 47 -0.52467961 -0.88746784 -0.78545763 H 11.19491572 11.17251717 7.44120718 1 0.19323310 -0.05327529 -0.07088044 Ag 13.01461100 13.10087291 7.43614127 47 0.65371430 -1.18185779 1.88371899 H 13.07888711 11.19472589 9.33493963 1 0.10475021 -0.01219767 0.00788898 H 11.18730691 13.06752488 9.29853684 1 0.10881460 0.07598054 0.17272531 Ag 14.99825957 11.21076211 7.49326487 47 -0.65706013 0.11522041 -2.02514292 Pd 16.82196382 13.10557693 7.43723668 46 -1.52913138 -0.40984005 -0.88626349 Ag 16.81250611 11.21505789 9.30308573 47 0.14496837 -1.32710078 1.45795919 Ag 14.93125267 13.10062693 9.36207736 47 -0.85765044 -0.63133786 -0.53844499 Pd 18.72290398 11.17861529 7.48864804 46 0.06297376 -0.68413465 -0.59564200 Ag 20.56848547 13.05892487 7.43695451 47 1.54898574 0.80387388 1.14181798 H 20.52005336 11.17876767 9.35124467 1 -0.64729890 -0.33644860 -0.10356129 Pd 18.69151070 13.09135195 9.36235111 46 1.58435310 -0.35119529 -0.56835415 H -0.01316181 14.90847294 7.50225621 1 0.71136295 0.34514613 -0.13560686 Ag 1.83239353 16.82536579 7.44450299 47 2.19229279 -1.48080625 1.19784767 H 1.87063254 14.88153679 9.28782819 1 -0.15383453 0.13638832 0.33709945 Ag 0.02345969 16.82017681 9.36677574 47 -0.45047229 -1.65718272 -0.59677593 H 3.73024449 15.01085104 7.47303606 1 -0.15809578 -0.04463997 -0.16518870 Ag 5.62500583 16.80646511 7.46152948 47 -2.40864153 0.07067802 0.55132513 H 5.56447219 14.94648465 9.31152255 1 0.01483005 -0.12421823 0.15583529 H 3.75170575 16.81371128 9.37064581 1 -0.05664455 0.01685935 0.07442815 Pd 7.46202912 14.97273657 7.47729514 46 -0.06912075 -0.37002870 1.39469441 Pd 9.31847764 16.83489595 7.44079227 46 0.42159364 0.69366130 -0.37125935 Pd 9.28581202 14.92657429 9.28493570 46 0.34605406 0.37544543 0.18517739 H 7.43536340 16.80548624 9.31563704 1 -0.03086225 0.13623131 -0.16187871 Pd 11.14816638 14.92317639 7.45132267 46 -0.20689315 0.33179847 0.36203886 H 13.09637800 16.82162670 7.51523807 1 -0.21774711 0.13516742 -0.04127688 Pd 13.10809272 14.94959579 9.34972929 46 -0.43684115 0.17112833 -1.51737660 Pd 11.22573882 16.82768601 9.35632168 46 0.37909166 1.14293543 0.49074403 H 14.95598890 14.98308574 7.42835877 1 0.05739342 -0.18019483 0.06388754 Pd 16.81949260 16.78171522 7.53217964 46 0.14494738 0.46715548 -0.19115146 Pd 16.86583482 14.91814567 9.36454220 46 -0.36721164 0.85653829 -0.72068304 Ag 14.93193058 16.82319385 9.33269623 47 -1.47668617 -0.37545062 -1.56437218 Ag 18.64088831 14.90646796 7.45112327 47 2.08963466 1.69251862 1.16413522 Ag 20.56682706 16.82930505 7.45503860 47 -0.51315014 0.43187165 0.14779743 H 20.50265611 14.88906645 9.33964173 1 -0.27925157 0.14490176 0.04378473 H 18.68073455 16.80677500 9.32887311 1 0.44321114 0.53046011 0.09436631 H 0.03089731 18.63968969 7.49868033 1 0.63423876 -0.17466198 0.18391195 H 1.86977117 20.53791453 7.46223957 1 0.37649680 -0.67270538 0.17199772 Ag 1.85405524 18.69573556 9.32300720 47 2.30591288 -0.63962495 -0.63197687 Ag -0.02424832 20.52709564 9.34803403 47 -0.35777196 0.55545802 -1.45767309 H 3.75716653 18.66398469 7.49523958 1 -0.20756612 0.36358697 0.00807423 H 5.65909952 20.57912463 7.42639530 1 -0.30471780 -0.69317118 0.17550152 Ag 5.63700506 18.65929234 9.36087245 47 -1.99854167 -0.44208484 -1.33751997 Pd 3.74173957 20.53531221 9.34386172 46 0.08983683 -0.65959404 -1.15350417 Pd 7.46044393 18.66006037 7.47706147 46 0.28887466 1.51894998 -1.10393408 H 9.34286574 20.52716592 7.48772096 1 0.26230498 -0.59599541 0.39478312 Pd 9.34914924 18.68894712 9.35607628 46 -0.11052259 -0.80805459 0.62308074 Pd 7.48738186 20.57831106 9.31856973 46 -0.03847829 0.75453183 -1.18940754 Ag 11.17202815 18.67961530 7.50548920 47 0.10943618 -0.46798701 -0.93116124 Ag 13.06151622 20.57534148 7.49054708 47 0.27240387 0.67975376 -0.03906250 H 13.06996760 18.66054474 9.33045682 1 -0.01446461 0.44340208 -0.09691575 Pd 11.20242890 20.53283761 9.36366755 46 0.77615628 -0.62578114 0.66718015 Ag 14.97706473 18.72033544 7.48279829 47 -1.14916149 -0.44264410 -1.14332700 Pd 16.83577072 20.56327591 7.44109087 46 0.37230309 -0.01877135 -0.50438525 Ag 16.84452916 18.69395001 9.34484237 47 1.90165936 0.32790959 -0.79394322 Pd 14.92641952 20.51529952 9.36533775 46 -0.95203133 0.47686214 0.71446387 H 18.69075101 18.65007642 7.46349582 1 0.01633503 0.43842645 0.14361211 H 20.55258054 20.57464694 7.54140382 1 -0.97674164 -0.77487264 0.32125328 Pd 20.53821563 18.69584676 9.35158863 46 -1.62712889 0.48519257 -0.83390596 Pd 18.65460900 20.57442746 9.33626738 46 0.83077601 -0.67175672 -0.68812851 Pd -0.03079154 0.05319434 11.20274257 46 0.51031467 -0.28264147 -0.56988018 Ag 1.87777757 1.86386157 11.19705281 47 0.54081551 1.47481277 -0.81001096 Ag 1.90912874 0.02660899 13.05992414 47 -0.18886401 -1.07881320 1.14556894 Ag -0.01299689 1.85181059 13.07200516 47 -0.22524373 0.92625774 1.05251964 Pd 3.72528345 -0.00079049 11.21385145 46 -0.43468749 -1.10613850 -0.44956079 Pd 5.57038277 1.83970468 11.18446681 46 0.89659412 0.58483064 -1.03829157 Pd 5.62945206 -0.00087370 13.05998950 46 0.88616565 -0.11149733 0.09324893 Pd 3.73445272 1.90440292 13.03856372 46 -1.12622049 0.92689387 0.32714636 H 7.50459958 0.02802094 11.18343431 1 -0.03288887 0.59983485 -0.13832146 Pd 9.36644780 1.89079817 11.23166443 46 -0.43026652 -1.08035887 -0.59003458 H 9.31961716 0.02537519 13.08816227 1 0.45892340 0.74419449 0.17314412 Pd 7.48996153 1.85912070 13.02695825 46 0.06975348 -2.27331539 0.07975614 Ag 11.19222791 -0.01667248 11.19480540 47 0.05992062 -0.41313272 0.73241315 H 13.08271817 1.89554555 11.16503769 1 0.06173515 -0.58143623 0.11241141 Pd 13.07805703 -0.00760265 13.07749437 46 -0.08791653 0.17020552 -0.53509717 Pd 11.18126504 1.87215511 13.07571501 46 0.55213712 -0.69802392 -1.09355037 Pd 14.95785579 0.05242743 11.20309075 46 -0.95202704 -0.07645318 -0.02312434 Pd 16.78717391 1.84673246 11.17072505 46 1.26483003 1.28976814 0.01541866 Ag 16.79141101 0.01075451 13.05067871 47 1.56680678 -0.27304002 0.28923386 Pd 14.96735731 1.89638404 13.09963791 46 0.53997766 0.77486679 -0.99653405 H 18.68090516 0.03571713 11.19208989 1 -0.22908967 0.80374929 -0.35099963 Ag 20.54485870 1.84052350 11.20522081 47 -0.74192621 -0.34447757 0.42464810 H 20.52639325 -0.03651870 13.07004265 1 -0.54956652 0.90480052 0.01449401 Pd 18.70845758 1.89624395 13.04836546 46 -1.17341127 -0.57031928 -0.04594978 Pd 0.02881570 3.75849456 11.23395628 46 0.45558371 0.32147737 0.59940936 Ag 1.86501636 5.63583765 11.16579926 47 -0.18614598 -1.00378118 -0.52052412 H 1.87232807 3.72321050 13.08612721 1 -0.42175067 -0.24981496 -0.03517839 H 0.01307529 5.60361228 13.05349312 1 0.65268057 -0.44711723 -0.13620563 H 3.66736134 3.72310110 11.20539040 1 -0.02746908 -0.10119208 0.09321874 Ag 5.63332667 5.57190712 11.18904502 47 -2.25705031 0.57845314 -2.57893303 Ag 5.61365752 3.76981770 13.00514764 47 -1.13049124 -1.91789022 0.43190751 Ag 3.72841615 5.61373325 13.06031970 47 -1.47403859 -0.74347564 0.37444292 Ag 7.47269945 3.71527363 11.17598764 47 0.75505285 -0.96633266 -2.50887915 H 9.37386480 5.62467102 11.20909323 1 -0.16043116 0.21798300 -0.10278465 Ag 9.33004007 3.69786926 13.08240165 47 1.75308238 1.17123535 -1.44529537 Ag 7.46649600 5.59846169 13.03369161 47 0.92315784 0.85559214 0.26509638 H 11.16938644 3.72835632 11.22363734 1 -0.05868737 -0.44134094 0.03767542 H 13.08169840 5.60799935 11.25516422 1 -0.08807167 0.14504546 0.15436325 Pd 13.03472320 3.70482156 13.07858592 46 0.14662979 1.58316525 -2.05083861 H 11.16174522 5.59015567 13.07187182 1 0.22347779 0.17824476 0.08399107 H 14.88071411 3.72286026 11.24113110 1 0.18815027 -0.23329760 0.04576327 Ag 16.77022659 5.59209936 11.23156806 47 -1.12180346 -1.52667553 2.19786783 H 16.84126674 3.72933466 13.04033568 1 0.17386032 -0.34547246 0.03125341 H 14.89686331 5.62974784 13.12734482 1 -0.04734499 0.14451918 0.17747771 H 18.69443826 3.71703688 11.20840195 1 0.29803815 -0.26177350 0.03280674 Ag 20.53687645 5.66325804 11.18090857 47 0.77686746 -0.48233529 1.83829619 Ag 20.56043110 3.74748116 13.10824846 47 -0.03985030 1.22050456 -0.06223596 H 18.69419386 5.64838058 13.06221512 1 0.04117106 -0.01132304 -0.03955082 H 0.00022273 7.44611548 11.25110804 1 0.70055356 -0.06248907 -0.27863943 H 1.91191790 9.31987791 11.19510866 1 -0.03472223 0.07995977 0.03242638 Pd 1.87285874 7.45574464 13.09295278 46 -2.52578983 0.04372684 0.34726290 H -0.01982405 9.33620665 13.03621751 1 0.66977674 0.53241152 0.27423311 Ag 3.74309270 7.46710682 11.23001465 47 -0.02510569 1.18972168 -2.33898032 Ag 5.63052016 9.33903007 11.17021722 47 0.44905973 0.29390948 -1.88290035 H 5.60189877 7.49696680 13.11441556 1 -0.16988525 -0.04799956 -0.27872480 Pd 3.73320179 9.31172054 13.06205249 46 0.01663510 -0.02305435 0.35832296 Ag 7.48648724 7.44995454 11.19725713 47 -0.40560549 0.51126301 -1.26347825 Ag 9.36469861 9.36429202 11.21764764 47 -0.57669056 0.88805745 -2.38646915 Pd 9.30973180 7.48303056 13.05265419 46 1.12804866 -1.76940514 -0.54059747 Ag 7.50238571 9.32681366 13.12218329 47 -2.85987912 0.83867921 -0.34303056 Pd 11.17613315 7.50428239 11.17590061 46 1.42394892 -1.42194465 -1.27873156 H 13.06334585 9.34839671 11.22847692 1 -0.11579595 -0.17641259 0.18198253 Pd 13.07045972 7.44294767 13.05841772 46 0.78980106 -1.83120817 -1.06481895 Pd 11.21382255 9.30813056 13.10616535 46 1.38354933 0.61514068 -0.64628672 H 14.90641527 7.48579110 11.24339626 1 0.05399879 0.10052458 0.18966379 H 16.84887469 9.34916706 11.17074435 1 0.03763300 -0.04997265 -0.00583520 Pd 16.82337635 7.47223309 13.09065860 46 -0.84078186 -0.47072914 -1.13222470 Pd 14.90946269 9.32494122 13.04720506 46 -0.38448916 1.19796688 -1.77804325 Ag 18.66550815 7.46631892 11.24083528 47 -0.17258108 0.60192205 0.87675151 Pd 20.51820119 9.34778911 11.23717732 46 0.58490546 0.55755158 0.38632747 H 20.56300444 7.53164135 13.10799627 1 -0.50005638 0.28209690 -0.22925694 Ag 18.65242870 9.33011895 13.05899520 47 0.64404741 0.42607772 -0.47134768 Ag -0.01465328 11.18686983 11.21721247 47 0.54877896 -0.01653731 1.00192636 H 1.90391359 13.03677008 11.18544711 1 -0.29041809 0.19167902 0.08354875 H 1.89311209 11.22591389 13.01723599 1 -0.34538239 -0.03628209 0.23689922 Ag 0.00222173 13.05147731 13.06316017 47 0.73603647 -0.72328409 0.26920796 Pd 3.76716139 11.16745919 11.21745407 46 -1.41938657 0.09750434 0.00666472 Ag 5.60954085 13.06857091 11.20425251 47 -0.98456780 -0.14282323 0.04127595 Pd 5.60447479 11.18936218 13.09420573 46 0.63795282 -0.06736480 0.76222070 H 3.69668059 13.06047909 13.13294197 1 0.02538028 -0.03477956 -0.16062180 H 7.46822520 11.19094305 11.21683828 1 -0.01514126 0.08322375 0.11133557 Ag 9.33909154 13.03705475 11.19500414 47 0.85888890 -1.01418403 -1.01407175 Ag 9.30046475 11.21832491 13.13403499 47 0.25550523 0.57363462 -0.38057447 Ag 7.44846966 13.10051014 13.05739301 47 -1.26285842 -1.08489882 0.46216282 Ag 11.21423462 11.23552023 11.24147857 47 1.79870722 -0.80951220 -1.30285410 Ag 13.04983171 13.07163620 11.23716211 47 0.46000042 -1.24119150 1.47358665 H 13.10377296 11.25293968 13.04112767 1 -0.24831717 -0.22148032 -0.13178662 H 11.15137345 13.09131622 13.01998318 1 -0.09307149 0.06563657 -0.02108408 H 14.96054916 11.17439949 11.25626344 1 -0.10367986 -0.09683380 -0.06033929 Ag 16.84128805 13.04138726 11.18267628 47 -1.93649297 -0.76898005 1.07264008 Pd 16.82573123 11.22761696 13.10115805 46 -2.08524545 -0.61308877 -0.93488225 H 14.88726740 13.08165756 13.07535262 1 0.22856406 0.13041485 -0.22525619 Pd 18.68995318 11.20463064 11.18542919 46 0.63087794 -1.08995171 -0.11163829 Ag 20.53043501 13.08873991 11.19689430 47 2.03578462 -1.30667937 -1.00469031 H 20.55956176 11.17277468 13.10649955 1 -0.51649722 -0.23269310 -0.20819757 Ag 18.64527357 13.07394075 13.05728070 47 1.69106213 -1.13296663 1.24939419 Pd -0.00526286 14.92892186 11.21950693 46 1.46954039 -0.46185296 -1.11203323 H 1.89820996 16.80317038 11.24617302 1 -0.53108182 -0.26300180 0.04460173 Ag 1.92988433 14.93418707 13.09256455 47 -0.23673769 -1.73886698 -1.48435699 Pd 0.03161186 16.82000935 13.05713181 46 0.15351839 0.41870003 -0.70967558 Pd 3.72303061 14.98230719 11.19519548 46 -0.60013290 0.05716831 -0.83574833 Pd 5.62876522 16.77508736 11.17333880 46 -0.17328272 -0.44404200 -0.40640020 H 5.57007904 14.94664257 13.06426605 1 -0.17856411 0.12643388 -0.11506457 Pd 3.72781488 16.80502986 13.08376084 46 -0.44354800 1.05771335 -1.56291389 Ag 7.45922215 14.94875841 11.23998576 47 -0.79519698 2.89341919 -1.03959042 H 9.36575042 16.81947973 11.19896085 1 0.02499529 0.08748398 -0.07198654 Ag 9.31107735 14.92932196 13.04599971 47 0.76097285 2.16415870 0.82162695 H 7.48814003 16.79990367 13.10501257 1 -0.07414677 0.06708766 -0.12725193 Ag 11.19713772 14.94972356 11.22075213 47 0.09372453 -0.47935401 -0.47053191 Pd 13.08295305 16.83061029 11.20401589 46 0.08044566 0.67833079 0.47662820 H 13.09175835 14.92876475 13.09432974 1 -0.26654224 0.08251135 -0.11618853 Ag 11.21774173 16.80196571 13.02403979 47 -0.74365730 1.00776449 0.38989002 Pd 14.93580907 14.90510406 11.21471877 46 -0.48882443 0.32148435 2.05029150 Ag 16.79643897 16.80640587 11.18112073 47 1.13292468 0.24713857 1.27202305 Pd 16.76311582 14.95611856 13.09603917 46 -0.17383299 0.88292594 -0.51672861 H 14.91224847 16.82121710 13.09226387 1 0.03328890 0.27353123 0.03646106 Ag 18.67037104 14.95198106 11.20367368 47 0.44819327 1.85564050 -0.75257337 Ag 20.51761759 16.81870781 11.17014780 47 0.06558877 0.77065864 -0.32585851 Ag 20.50812048 14.93221817 13.06288973 47 1.73390084 0.70323702 1.17348576 H 18.69394338 16.85346731 13.05039910 1 0.19930971 0.00741112 -0.03545773 Ag -0.00698904 18.64537328 11.19121940 47 -0.25167786 0.10028035 2.14340501 Ag 1.87876894 20.54296298 11.22115313 47 0.32528289 0.21444176 1.40105497 H 1.82938475 18.66377810 13.04385223 1 -0.03399238 0.19184335 0.14286417 H 0.01783901 20.57500070 13.05521326 1 0.67842684 -0.61124514 0.02352235 H 3.69701441 18.65504262 11.19033001 1 0.11378310 0.60602047 -0.11117561 Ag 5.59306968 20.54243538 11.22426519 47 -1.14435331 1.51380959 -0.53404174 Ag 5.57781122 18.70406214 13.09547578 47 0.28157940 -0.63911301 0.61674753 Pd 3.69131514 20.51174791 13.04088118 46 -0.22487984 -0.64217337 0.15584392 Ag 7.44814836 18.64615596 11.17064783 47 1.45631087 -2.23580342 0.41853959 Ag 9.31813550 20.55346521 11.16931877 47 0.94712024 0.91307886 -0.49828277 Pd 9.40267053 18.66030504 13.04931667 46 -0.43287013 -1.75900517 0.39380314 Ag 7.48106665 20.54892713 13.04702024 47 -0.30459861 0.94393131 1.95619465 H 11.16032517 18.66638090 11.23421381 1 -0.13179801 0.27095703 -0.06008737 H 13.06267635 20.52867710 11.19121853 1 0.05785136 -0.44457538 -0.06508008 Pd 13.05650177 18.66002183 13.04670438 46 -0.28636179 0.40822279 -0.69592311 Ag 11.19344745 20.52153826 13.04129928 47 1.19071285 0.23038716 -0.86788359 Ag 14.93336658 18.65464123 11.21968988 47 -1.19156121 1.02752348 0.40378937 Pd 16.79970182 20.55704791 11.21179298 46 0.50396526 0.59782456 0.45133805 Pd 16.82598102 18.62239582 13.09175125 46 1.20528018 0.14458576 1.11949208 Pd 14.96001553 20.53329043 13.09775940 46 0.33371876 0.39041411 -0.15601526 Pd 18.67154773 18.73036150 11.21961293 46 1.15364956 0.07578504 1.00947659 H 20.54247671 20.57137685 11.18046662 1 -0.85177618 -0.91205419 -0.54055394 H 20.50792079 18.66742661 13.08544608 1 -0.45806772 -0.04201776 0.23237625 H 18.69714350 20.55567259 13.08607350 1 0.02074438 -0.67548308 -0.02827288 Pd -0.02385019 0.02093223 14.93128365 46 1.46260966 0.72878190 0.35356991 H 1.84130875 1.89018800 14.93205441 1 -0.46584939 -0.25682512 -0.02473086 H 1.86779376 -0.02717941 16.81182458 1 -0.11081957 0.67451489 0.12860314 Ag 0.01707714 1.83973940 16.76376557 47 0.38268525 0.17864935 -0.09473553 Pd 3.72407181 0.03493683 14.91793193 46 -0.55347763 1.01074587 1.71871998 Ag 5.61728126 1.89949656 14.97609384 47 -0.57230924 -1.09909693 1.31842614 H 5.60787887 0.02419638 16.81176949 1 -0.33827616 0.63134959 0.33648390 H 3.75549304 1.85209333 16.80837379 1 -0.20740049 -0.40546567 0.21991752 H 7.47238846 -0.03036541 14.98545193 1 -0.27917933 0.67865034 -0.17812191 Pd 9.33801464 1.86600371 14.93042973 46 -0.33221049 -1.62521492 0.95153108 H 9.33372603 0.00089464 16.79733553 1 0.47788046 0.75991340 0.21138440 Pd 7.43672325 1.87670645 16.79553058 46 0.40915862 -0.64442003 -0.35493370 Pd 11.18642360 -0.00615916 14.95433842 46 -0.43413528 0.16892270 0.49480309 Pd 13.10660919 1.86943853 14.95223298 46 -0.40087593 -0.64630990 1.24260420 H 13.08492357 -0.02347419 16.81224141 1 -0.24204875 0.66282871 0.08769525 Pd 11.19954004 1.88391275 16.79931511 46 0.70579676 -0.21337494 0.63911393 Ag 14.96750227 -0.01412487 14.94610097 47 -0.39211296 -0.47618462 0.68627493 H 16.77046383 1.90963733 14.95118178 1 -0.04312539 -0.26051841 0.12524598 Pd 16.81590855 0.01385494 16.81619253 46 1.40628704 -0.00137562 -0.53296037 Pd 14.97501130 1.87330186 16.80794760 46 -1.38809068 -0.41435108 0.04883633 H 18.64079127 0.03513064 14.95523752 1 0.17454495 0.72128288 0.36426506 Pd 20.50236218 1.89067794 14.96807291 46 0.35016159 -1.42571633 -0.31287195 Pd 20.52514733 -0.01991933 16.81525944 46 -1.55615465 0.62646699 0.18109262 Ag 18.69740596 1.86275852 16.79903441 47 -0.64938904 -1.92736265 -0.84468315 Pd 0.02023869 3.74592459 14.95629733 46 1.79827118 0.63031652 -1.19077886 H 1.82761721 5.65641218 14.93448921 1 -0.20490901 -0.22773481 0.24871369 Pd 1.92226475 3.74914769 16.78880183 46 0.08904333 -0.80293401 0.04749215 Pd 0.00032614 5.63263081 16.82954479 46 0.62014872 -0.37841552 -0.75743986 Pd 3.73561296 3.77205715 14.90465861 46 -1.50876781 -1.04671199 0.43974363 Ag 5.59096600 5.63514365 14.91911180 47 0.87702697 -0.32099154 1.10281191 H 5.60251570 3.71153496 16.81317286 1 0.10718780 -0.32194509 0.00929277 Ag 3.76195466 5.57356887 16.80436562 47 0.28023650 -1.24053128 1.28112779 Pd 7.51680315 3.70741581 14.91864609 46 -0.45895699 0.75367685 1.94141778 Ag 9.32923945 5.59095894 14.98131725 47 -0.10043967 -0.62335437 0.10684234 H 9.35168621 3.73526665 16.76189180 1 0.05526625 -0.46455171 0.09754869 H 7.50064124 5.58820304 16.80425448 1 -0.02284827 0.14550066 0.06804578 Ag 11.22310466 3.74768504 14.94666194 47 1.11160091 0.43889008 0.51270878 H 13.09959785 5.60749119 14.95491086 1 0.03330625 0.01710536 -0.17580154 H 13.03809773 3.74735078 16.83206266 1 -0.02643008 -0.25448839 0.00001118 Ag 11.19430187 5.60210678 16.82019312 47 0.86068520 -1.14494051 -0.90454976 Ag 14.96945289 3.70535373 14.93484495 47 -0.36380255 1.11885286 -0.20446128 Ag 16.81405697 5.58112293 14.96288072 47 -0.63046083 0.39555616 -0.79216574 Pd 16.84935636 3.73701011 16.80333357 46 -0.66453373 0.27592712 0.17366706 H 14.93561417 5.57154900 16.81145573 1 -0.06655773 -0.06596492 -0.04034278 Pd 18.68403684 3.74696785 14.90654867 46 -0.62433013 0.26828598 -1.12930154 H 20.55386015 5.62005472 14.96285403 1 -0.66745348 -0.27054870 0.01573043 Ag 20.52378858 3.72042441 16.81969672 47 1.76286470 1.17935617 -0.47088278 Pd 18.62950323 5.58114097 16.82318519 46 0.32140569 1.54725088 0.58359586 H 0.00547263 7.46068697 14.90458882 1 0.68763680 -0.05511393 0.27758182 Pd 1.90314239 9.32373716 14.93122576 46 -1.85004021 0.66732862 0.16227018 Pd 1.87925938 7.47844609 16.81586715 46 -1.39754531 -0.16512921 -1.28506791 H 0.00769424 9.33877992 16.84063696 1 0.57345166 0.34922566 -0.10938772 Pd 3.71945835 7.42141728 14.97513896 46 0.26694078 0.39160865 -0.87852348 H 5.59509286 9.32054794 14.96726653 1 -0.22526392 -0.01587276 -0.10958887 Pd 5.60441717 7.47475204 16.80952379 46 1.24102889 -0.02473669 0.26838118 Pd 3.76190788 9.30052487 16.81818697 46 0.28681533 2.08289478 -0.10271315 Ag 7.46735985 7.47775402 14.95377236 47 -1.81540724 0.47640920 1.24262622 Ag 9.30445488 9.31118218 14.90887570 47 0.10554407 0.91167672 2.15361883 Pd 9.32424432 7.45206263 16.79212171 46 -1.04055195 0.87779870 1.00232439 H 7.48397313 9.36998504 16.79951575 1 -0.06570934 -0.05214648 0.28703725 Pd 11.19987577 7.45285773 14.90966706 46 0.86386780 -1.03265487 -0.58397872 Pd 13.10587659 9.35367060 14.95957479 46 0.55492017 1.10093921 -0.83356969 Ag 13.03633675 7.49126968 16.80428588 47 1.83298041 -0.98751244 -0.31133221 Pd 11.17624881 9.36883549 16.82133768 46 -0.62663822 0.39846713 1.26532815 Pd 14.95840463 7.45372954 14.95570358 46 -0.08428246 -1.55506407 0.61770237 Pd 16.83961992 9.35987553 14.93950810 46 -1.12924001 -0.23995634 0.53710334 H 16.76738877 7.47538617 16.77955106 1 0.23106476 0.11682576 -0.07172305 Pd 14.97690868 9.34587085 16.80792813 46 0.58560653 -0.90853724 -0.18674090 Pd 18.63878375 7.46660579 14.93662513 46 1.36550359 -1.30560041 0.30793934 Ag 20.53239310 9.30988252 14.95030651 47 1.37796693 -0.14708555 0.01970647 H 20.52650399 7.45886295 16.78429859 1 -0.74016288 0.06594841 0.37660895 Pd 18.70214140 9.36818932 16.77389269 46 0.48368414 -1.03931758 0.85996849 Pd 0.00956680 11.13937465 14.94904467 46 2.18891360 -0.13966911 0.66768981 H 1.83969287 13.08221256 14.95763477 1 -0.36507819 -0.09084723 -0.03832684 H 1.87612235 11.19313662 16.79355736 1 -0.31517575 0.03271289 -0.15312693 H 0.01540673 13.04927983 16.84265270 1 0.45804095 -0.00794994 0.16793854 Ag 3.71116317 11.20546044 14.97311715 47 -0.90985968 0.18281006 0.03704257 Ag 5.62785774 13.07020766 14.97041561 47 -0.67350781 -1.01914429 -0.97309931 H 5.59214550 11.20026079 16.75470255 1 -0.12790006 0.25539630 0.31202558 Pd 3.70247285 13.07719382 16.82308317 46 -1.40425140 -0.63783969 0.51196115 H 7.49983170 11.16972196 14.92649679 1 -0.10924366 0.22168469 -0.04417413 Ag 9.32490043 13.08538383 14.93480842 47 0.85734553 -0.67740087 -0.31102471 Ag 9.30800501 11.23134277 16.84233165 47 0.43673460 -1.22899570 0.99854548 Ag 7.47076018 13.05515477 16.80707129 47 -0.43577165 -0.07921590 1.26475926 Pd 11.21605416 11.17451209 14.93148873 46 1.22217067 1.28498163 -1.04327734 H 13.03466152 13.05463427 14.98031340 1 -0.24729408 0.11450537 0.14512848 Pd 13.10818661 11.21895292 16.79029699 46 -0.16694553 0.59180099 -0.76961724 Pd 11.22127242 13.11396355 16.80140416 46 0.88756252 -0.40303467 0.69345720 H 14.90139665 11.23815801 14.95288103 1 0.06669602 -0.22699761 0.03881759 Ag 16.78174243 13.06184168 14.88194307 47 -0.78521390 -1.02781383 0.68409316 Ag 16.85877633 11.20061958 16.78870079 47 -0.08167550 0.75634188 -0.40499168 Pd 14.95433307 13.01846992 16.78993241 46 -1.17052023 0.29092217 -1.15742600 Pd 18.69640638 11.20107235 14.97317415 46 2.03850040 1.60220492 0.33224317 H 20.52372894 13.08398564 14.96084856 1 -0.47453488 0.28652687 0.02288696 H 20.52488552 11.13639147 16.75024045 1 -0.62317327 -0.29929263 0.29565543 H 18.68585192 13.07525652 16.77098674 1 0.27944899 0.24836936 0.36178901 Ag -0.00452106 14.90919576 14.97525179 47 -0.14625494 -0.99397666 1.45276100 Ag 1.85860273 16.82608963 14.90387354 47 0.66189425 0.38701604 1.35084511 H 1.83048102 14.93110878 16.79846210 1 -0.45890621 -0.00258304 0.22451896 Pd 0.00822025 16.83879997 16.83315129 46 0.67266331 -0.64004904 0.84937601 Ag 3.74774607 14.94942414 14.93631604 47 -0.43836311 -0.56642630 0.48462908 Pd 5.59527852 16.84930920 14.92943988 46 0.94356126 -0.20612694 -0.63857552 Ag 5.61855943 14.97458960 16.81639009 47 -0.97773736 1.51129141 2.42376018 H 3.77624014 16.86776394 16.82623036 1 -0.03804129 0.32358476 -0.12262997 Pd 7.50034796 14.96749256 14.91962056 46 -0.33439709 1.57152502 -1.08231717 H 9.32891077 16.80231136 14.94470373 1 0.07345411 -0.10900254 0.01278351 Ag 9.37850308 14.91314958 16.82108673 47 -0.28357066 1.99989807 1.79683237 Pd 7.43415873 16.77541861 16.84423319 46 0.92557137 -0.10330685 0.75109440 Pd 11.20618141 14.97134094 14.98092086 46 1.26516785 0.14333282 -0.21129284 Ag 13.06180484 16.82442115 14.91144497 47 -0.43926056 -0.52200290 0.37677092 H 13.05298742 14.89507430 16.78278956 1 -0.07281464 0.07290046 0.07058326 H 11.22302249 16.80622753 16.76759817 1 0.08877927 0.07010832 0.14113854 Ag 14.97067191 14.95280200 14.92239269 47 -2.87307777 -0.58795455 -1.15090940 Pd 16.80974819 16.78032463 14.97690477 46 0.48296651 1.30562938 -1.37159939 Ag 16.78931887 14.93406698 16.83817497 47 0.87491125 -0.44787508 1.15332438 Ag 14.92499653 16.83674903 16.84206346 47 0.27873987 -0.25842736 0.21470842 Ag 18.69196938 14.94717112 14.98562343 47 0.58982191 -1.00410061 -0.42499118 Pd 20.53260803 16.81466332 14.93635745 46 -0.41072869 1.44251578 -1.20343929 Pd 20.54151658 14.90608370 16.79836172 46 0.29539619 -1.18454540 -0.29188534 Ag 18.64380632 16.81113916 16.76543895 47 -0.19442359 1.06410383 0.63221224 Ag -0.00138907 18.67027506 14.92386754 47 -0.87127050 0.85737800 -0.97003013 Pd 1.88692096 20.50782448 14.93195466 46 -0.40756332 -0.01271149 -1.07948134 Pd 1.87599074 18.69289789 16.80241670 46 0.47893356 -1.18892296 0.91893413 Ag 0.02496076 20.56846744 16.83367515 47 -0.35262944 0.42919821 0.21889527 Pd 3.77351846 18.66570969 14.96621725 46 -0.42083872 0.34762423 0.16296897 H 5.58896812 20.54843019 14.94023763 1 -0.22846026 -0.53216359 -0.15058932 Pd 5.65558630 18.64551884 16.81145233 46 0.03448866 0.21702005 -0.61875520 Ag 3.77041691 20.56828303 16.80430723 47 0.06372255 1.03367018 -0.88477633 H 7.45272263 18.64940035 14.92696735 1 0.11830446 0.20122330 0.08960633 Ag 9.39744735 20.56547795 14.95309464 47 -0.26361004 -0.01040765 1.33449492 Ag 9.32279504 18.64398924 16.79232295 47 0.62473090 -1.11533541 -1.47279553 H 7.44453817 20.57750665 16.81156725 1 0.18208636 -0.60591748 0.19025340 H 11.17538581 18.66079717 14.95907389 1 0.03431908 0.40297170 -0.18637864 Ag 13.08995612 20.53777200 14.92369446 47 -0.42576237 0.47807278 1.24446577 Pd 13.06457305 18.67194827 16.84400481 46 -1.23505387 1.48726258 -0.38730438 H 11.16790204 20.54684106 16.84850657 1 -0.13839843 -0.56252047 -0.06593284 Pd 14.91397477 18.68292301 14.93324277 46 1.00357476 0.51524796 -0.15958036 H 16.81131862 20.52988748 14.92234045 1 -0.00183932 -0.64773820 0.01589710 Pd 16.80739923 18.68343225 16.84658740 46 -0.04699471 1.32331920 -0.07420262 H 14.95020675 20.53102117 16.82841653 1 -0.06960274 -0.87609826 -0.00994940 H 18.68948588 18.69046400 14.90485673 1 0.45437814 0.28420194 0.55718348 Pd 20.55190520 20.55820866 14.95472267 46 -1.81458063 -1.61762871 -0.89768050 Ag 20.54243034 18.67437281 16.80973517 47 0.90192849 1.23155472 -0.73575579 Pd 18.65705512 20.56106003 16.86351433 46 -0.51957884 -0.55955494 -0.18882408 Ag 0.03534576 -0.03215796 18.70017642 47 0.29847540 -0.37028769 -0.50941244 Ag 1.88701610 1.92464098 18.69825390 47 0.48488928 -0.17774821 -1.78894528 Pd 1.88975858 -0.01921734 20.54295912 46 0.15943945 0.34416946 -0.29856774 Pd -0.02084622 1.85820883 20.51463603 46 0.36059133 0.56956592 -0.73565690 Pd 3.76083799 -0.00183281 18.64269330 46 0.34253252 0.82442575 -1.16415468 Pd 5.63941410 1.90353326 18.64684830 46 -2.11295267 -0.03719285 -1.18206336 H 5.55174393 -0.02236509 20.50868824 1 -0.27540893 0.72563114 -0.95812939 Ag 3.75132591 1.88432456 20.55535120 47 0.81311263 -0.23406829 0.48456639 Ag 7.44255233 -0.02284085 18.71010244 47 -0.73144863 -1.28092599 -1.24050445 Pd 9.34217469 1.82096951 18.67242217 46 0.68003453 -0.15038578 -0.90345634 Ag 9.33961891 0.02734124 20.55092666 47 1.10115543 -0.19864839 0.63637665 Ag 7.43793868 1.89318856 20.53344809 47 -1.02386754 -1.09877908 2.07853807 Pd 11.22474745 0.01073107 18.68318706 46 0.67381002 0.95962189 -0.87661325 H 13.12503866 1.87930871 18.66269096 1 0.04440424 -0.54301829 0.16128357 Ag 13.06301174 -0.02404056 20.51773791 47 -0.80341651 0.68496257 -0.47838498 H 11.19762115 1.88604913 20.51584680 1 -0.13690054 -0.62720949 -0.76049920 Pd 14.94610213 -0.03464920 18.69097961 46 -1.07109275 -0.06472833 -0.77065358 Ag 16.82933619 1.87282194 18.67233505 47 0.94761592 -1.67313770 -0.44654642 Ag 16.83215652 -0.02939273 20.56228648 47 0.64595585 -0.48056948 -0.13395122 Ag 14.90487898 1.90195145 20.51241335 47 -1.71122571 -0.64515161 1.44431903 H 18.67244394 -0.02104474 18.69078150 1 0.47687343 0.75846617 0.10961975 Pd 20.52841932 1.88920446 18.67606093 46 0.41288129 -1.00733409 0.11096033 Ag 20.50506588 -0.00068875 20.56167263 47 -0.85782294 0.34003440 -1.01846471 Pd 18.67851946 1.88645805 20.57707329 46 0.23094601 -0.74268164 0.17621299 H 0.01277005 3.76467831 18.67263586 1 0.75502131 -0.02865613 0.06017090 Pd 1.89937232 5.62286625 18.67447082 46 -0.03525713 -0.90059790 0.63324339 Ag 1.83721269 3.74198908 20.54789461 47 0.59981736 0.02077216 0.49409186 Ag 0.01387385 5.54678270 20.52814524 47 -0.43366161 0.37121233 -0.09896722 H 3.73866960 3.74576712 18.66199461 1 -0.16378586 -0.07029495 0.66646874 H 5.58327515 5.60076221 18.67117013 1 -0.25199385 0.18420344 0.70786513 Pd 5.63836642 3.75396706 20.52697902 46 -0.53764678 1.53737085 -0.53445074 Pd 3.76627183 5.61238204 20.51797890 46 0.23325123 -0.09436197 -1.14169594 Ag 7.47897061 3.74096341 18.70921196 47 -1.13935718 2.30778921 -2.36453814 Pd 9.33329048 5.58369108 18.66090631 46 -1.47426199 -0.35925821 -0.50868733 Ag 9.31425145 3.69834135 20.50666326 47 0.62819744 0.30118625 2.39587535 H 7.50341506 5.63637201 20.51775822 1 -0.15348235 -0.01956672 -0.43802514 Ag 11.17580954 3.76937116 18.69091684 47 1.47201399 -2.39820774 -0.42402864 Ag 13.07532474 5.58840892 18.71165697 47 1.82871675 -0.76656141 -1.08256707 H 13.02846759 3.75097893 20.56603232 1 0.22527279 0.23524345 -0.55447801 Pd 11.17021316 5.60858702 20.53584227 46 0.57179454 -0.56949463 1.48530715 Ag 14.95885942 3.70462403 18.69915167 47 -1.98161779 1.60612323 -1.81485014 H 16.79568241 5.60660808 18.64011093 1 0.10614563 0.06029059 0.39007759 Ag 16.78344788 3.70601650 20.50578704 47 1.62114053 2.21508330 1.76987576 Pd 14.93710920 5.62170223 20.55414554 46 0.40952855 0.21165910 -0.45074059 Pd 18.68287201 3.71965660 18.66513100 46 -0.22560105 1.28458927 1.05964208 Pd 20.56922310 5.60391390 18.71553885 46 -0.60892239 0.95163068 0.26232321 Ag 20.56899451 3.72979283 20.54767842 47 -0.27848949 0.66075971 0.17141116 H 18.64620132 5.53685644 20.56403860 1 0.15693355 0.04028035 -0.86389503 Ag -0.00407801 7.44697862 18.65144720 47 -0.64003409 1.05737036 0.31238535 Ag 1.84459835 9.36872682 18.67439650 47 -0.13735746 0.49628639 -0.36700597 H 1.83492627 7.46367041 20.57477249 1 0.19267716 -0.36871388 -0.75227997 H 0.00503311 9.31924435 20.56005007 1 0.63755864 0.23148830 -0.78543344 Pd 3.72254646 7.45323848 18.66411822 46 0.09616144 -0.68500550 1.11812068 Pd 5.53848064 9.34404419 18.64510363 46 0.15663593 1.77300465 -0.23620277 Pd 5.58089747 7.48388270 20.53130256 46 0.42528964 -1.29747696 -0.06882252 Ag 3.70634708 9.34341222 20.57199780 47 0.30326855 0.35490750 0.54643295 Ag 7.48719004 7.43269741 18.69050046 47 -0.73670348 -0.41471263 -0.65175276 H 9.34450170 9.34315316 18.66956407 1 -0.28706391 0.04180219 0.38900262 Ag 9.34547911 7.48879014 20.57168393 47 -0.00738328 0.75598480 0.76558297 Pd 7.43347125 9.31716164 20.48659653 46 -0.01772783 0.52971786 0.24803624 Pd 11.21547662 7.45150795 18.68422275 46 -0.88181328 1.61033881 0.65560639 Ag 13.09132980 9.37141574 18.69128790 47 -0.88838066 0.83023169 0.75836326 Ag 13.07713923 7.44878793 20.50523772 47 0.12260629 0.82515764 1.56293674 H 11.20742455 9.31828279 20.57519048 1 -0.14728535 -0.07579820 -0.40162775 H 14.89901068 7.47290314 18.64113940 1 0.08025128 -0.03141688 0.69663935 Ag 16.77702601 9.35304569 18.68513995 47 1.04833784 -1.84630011 -0.23242376 Pd 16.82040256 7.49481558 20.51805605 46 0.54585835 -0.73391810 -0.92210001 Ag 14.96575964 9.34898176 20.54548885 47 -0.57154301 -0.14152264 1.45189385 Pd 18.67839267 7.45545581 18.72961837 46 -0.18314110 -0.55132749 0.34573821 Ag 20.49789671 9.36929575 18.66692583 47 0.30627256 -0.63427524 0.12362970 H 20.56157854 7.43498967 20.54363779 1 -0.57030295 -0.12197311 -1.02384511 H 18.66975628 9.31482118 20.56715256 1 -0.10791411 0.09596930 -0.87549652 Ag -0.02558105 11.23534133 18.65310925 47 -0.41018219 0.23270761 -0.85012039 Ag 1.89174819 13.10674446 18.70061958 47 -0.52656729 0.86695152 -1.01313459 Pd 1.88454718 11.21365026 20.54357682 46 -0.38810547 0.07644520 -0.00892420 H 0.00714764 13.05054401 20.54715932 1 0.77947548 -0.03110325 -1.07939580 H 3.72169900 11.16338401 18.67196268 1 -0.16542725 0.21294064 0.31814120 Pd 5.53951462 13.08760105 18.67186632 46 0.15014442 -0.14123027 1.15359454 H 5.59034167 11.20305531 20.53485278 1 -0.03696790 -0.13157865 -0.68248524 Ag 3.72086547 13.09508408 20.54802690 47 0.83592976 0.64404305 0.16190929 Ag 7.44407687 11.20007401 18.65348211 47 -0.74198910 -0.48344992 0.63276881 H 9.31911169 13.10661972 18.68690307 1 0.17370371 0.09156950 0.37751531 Ag 9.32206754 11.23435693 20.53365117 47 0.52384114 -0.15376538 -0.72792807 H 7.46063362 13.12737923 20.56535955 1 0.32568315 0.04191738 -0.67628540 H 11.22136081 11.18408191 18.68468565 1 -0.18032169 0.23586163 0.11465188 Ag 13.05853421 13.09921208 18.68522605 47 -0.20699214 -0.84650059 -0.50679445 H 13.10978751 11.15837429 20.57390053 1 0.12041096 0.15024886 -0.36618819 Ag 11.22991292 13.10441394 20.55459180 47 -0.46892638 -1.25939913 0.44418204 Pd 14.96177798 11.22059197 18.64016142 46 -0.59593991 0.12766446 0.98580111 Pd 16.84214647 13.08578849 18.67557704 46 1.42387788 0.40545437 0.71420521 Pd 16.77761668 11.16666424 20.57920003 46 1.55016432 0.09796706 0.59810289 Ag 15.00799205 13.08833679 20.52943134 47 -0.00788735 0.21325111 1.34710275 Pd 18.67921091 11.23664984 18.68560710 46 0.47451188 0.49567551 0.39088188 Ag 20.50305403 13.05115753 18.69498383 47 0.05515305 -0.45920481 -0.34827378 Pd 20.57160926 11.20085913 20.53841016 46 -1.54208081 0.15173175 -0.29645390 H 18.70861870 13.06149666 20.55993960 1 0.58669341 -0.15827544 -0.83662059 Pd -0.02633973 14.94742240 18.70350138 46 2.15754208 0.28587998 0.17041748 H 1.89640574 16.79867667 18.65884125 1 -0.49982822 0.33404837 0.20248091 H 1.91908671 14.99709490 20.52447544 1 0.17892965 0.02706851 -0.80808539 H -0.02264967 16.82035571 20.56999160 1 0.70639204 0.20592282 -1.04147460 H 3.67631343 14.97872899 18.67056812 1 0.08725304 -0.31251805 0.31704051 H 5.60992942 16.80917640 18.69955956 1 -0.09116620 0.49391244 0.52543043 H 5.59183341 15.00347226 20.51781315 1 -0.41503917 0.24459968 -0.48959355 Pd 3.78747784 16.84447907 20.56559026 46 -0.19337553 -1.63373446 -2.27861925 H 7.46417386 14.99552162 18.70866578 1 0.14254243 0.05456072 0.15935891 H 9.29180318 16.84174203 18.68836334 1 0.04135953 -0.07836128 0.34541483 Pd 9.34000267 14.94239366 20.54464838 46 -1.26895235 -0.62879948 -1.57322659 Ag 7.49350313 16.83424667 20.56799139 47 -0.10495171 -1.10471333 -0.43262743 Pd 11.22378747 14.95009445 18.70745528 46 -0.88801919 0.68346900 -1.28511053 Ag 13.05445035 16.81953040 18.65535753 47 0.18841935 -0.90781241 -0.29036385 Pd 13.04839592 14.94218544 20.57201545 46 1.06681739 0.60632775 1.13215158 Ag 11.24148979 16.78640530 20.54619768 47 -1.55580468 0.68269820 1.21398151 Pd 14.95596084 14.97508488 18.64766114 46 0.27639164 0.97285329 0.96502359 H 16.78589491 16.81560522 18.66712955 1 0.35769005 0.34747194 0.09993822 H 16.84945743 14.95079709 20.54098859 1 0.35840595 0.13752057 -0.64593526 H 14.94780526 16.76234102 20.52579957 1 -0.41916816 0.17702013 -0.69033682 Pd 18.70807566 14.93112961 18.69698092 46 -1.07068416 -0.35314779 0.73367856 Ag 20.52508361 16.80241093 18.66385260 47 1.57777840 -0.36507686 0.72369630 Pd 20.57505517 14.96050895 20.53637269 46 -0.84108069 -0.43571166 -0.21809557 Pd 18.65985304 16.82186911 20.55383194 46 -1.64195938 -0.04322800 -0.55465754 Pd -0.00548085 18.64441753 18.63915275 46 0.56096201 -0.93022734 0.69026551 Pd 1.90336160 20.57862470 18.67829267 46 -0.28252278 0.55661113 0.18060178 Pd 1.85527356 18.70049800 20.54789108 46 -0.45979684 -1.20287661 -0.51082115 Ag -0.02489671 20.55068200 20.51585321 47 0.40314505 -0.49975858 -0.47835882 Pd 3.73790138 18.70982715 18.68317270 46 -0.44797503 -2.06255207 -0.50353450 Ag 5.62860155 20.51477711 18.64150509 47 0.41438711 1.62752235 -0.42627544 Pd 5.54361588 18.65495218 20.53214462 46 0.09542613 -0.61678730 0.57580350 Ag 3.75748925 20.54179709 20.55547201 47 -0.44152486 0.41483364 0.66244571 Ag 7.45839881 18.63898004 18.68645667 47 0.64383253 -0.83971523 0.08900428 Ag 9.34492901 20.55308895 18.66628422 47 -0.29584269 1.10421595 -0.87827752 H 9.32248472 18.71607609 20.57447602 1 0.00559953 0.17455302 -0.63960056 Ag 7.47764471 20.57797912 20.55462462 47 0.31818622 -0.10896825 0.99184806 Ag 11.22379339 18.70809403 18.68552574 47 -0.60611509 -0.32706330 -0.76457257 H 13.12189929 20.52563921 18.68532307 1 0.15463441 -1.01072683 0.70210855 Pd 13.05659518 18.72495717 20.53840818 46 0.84189166 0.04572603 0.33897410 Ag 11.18554225 20.53339465 20.55395801 47 0.38719251 0.29948978 0.58183592 Pd 14.91877064 18.64452001 18.69527032 46 1.45795276 0.87455717 1.00505353 H 16.83541331 20.53552868 18.74210230 1 0.25707725 -0.71773958 0.24749529 H 16.80286419 18.65941128 20.56342104 1 0.23759823 0.39470895 -0.61246163 Pd 14.96299914 20.51104536 20.56848674 46 0.63302717 -1.09617271 -1.65530975 Ag 18.65639940 18.66934926 18.64776675 47 -1.38131981 0.80503384 1.40113736 H 20.57048668 20.54801505 18.67956072 1 -1.09318386 -0.98139531 0.04195549 Pd 20.53241352 18.66048213 20.55596325 46 -0.44350473 0.14804091 -0.80531420 Ag 18.66932732 20.56260134 20.52467347 47 -0.72612944 -0.49663557 -0.84406826