99
Cartesian coordinates (A) of atoms in GaOP-PhCCH-ring-closure optimized at the RKS-PBEh-3c level
  Ga          8.69498621231727     19.44998941667513      4.82029567951529
  P           5.97462699167862     20.60688032817763      5.39304838866498
  Si          9.21572120557679     17.79027922389605      7.80006300741777
  Si         10.21057666016228     16.53351029124556      5.14609245615845
  Si          8.35270423580466     19.10751576235522      1.53702543807433
  Si         10.59333439197358     21.05316751865629      2.61229242394542
  O           6.71752856188257     19.58003292126428      4.51211720927191
  C           8.98669872687539     17.74732751754466      5.91656328325285
  H           8.01025460915073     17.24627472671405      5.79971550832548
  C           8.58038923520840     19.27464751753945      8.80266265488863
  H           9.19492150774765     20.16529751031269      8.68739431928964
  H           8.63391628213755     18.98632723266790      9.85606313868749
  H           7.55116825039370     19.56810208209710      8.60684381350857
  C          11.02508601329648     17.67962007790933      8.36641180292681
  H          11.62008571186874     18.53256501405778      8.03657796491681
  H          11.54568141832651     16.77920138575963      8.04478519222753
  H          11.04627601693611     17.68968761455511      9.45849982345283
  C           8.28273613690623     16.31028350939631      8.53433675693553
  H           8.41710479494775     16.26396320121057      9.61706050909720
  H           8.60657985380491     15.35493912109120      8.12349125499517
  H           7.20913107078086     16.39207535467087      8.34909775514833
  C          11.92970126356094     17.29686279351140      4.95853956616748
  H          12.59877509069761     16.61233539098643      4.43314110349951
  H          12.38934238549922     17.51826038220157      5.92215184874156
  H          11.91044670764233     18.22777296360216      4.39112139614640
  C          10.40922228302177     14.91070080503397      6.11522025091861
  H           9.46592832903189     14.36235694776524      6.15766855469967
  H          10.76914333470955     15.01789121656836      7.13718031842386
  H          11.12253502363120     14.27154848861094      5.58935861101645
  C           9.64264300966266     15.89624885857668      3.45773018383611
  H           8.65131870614645     15.44291152137805      3.52007188301009
  H          10.32764068883160     15.11666941985691      3.11665475951936
  H           9.60489230957334     16.65273772724593      2.67809157640829
  C           9.50426483711124     19.55635477785548      2.97265940346870
  H          10.23037556049882     18.72840913257509      2.95944704982146
  C           6.94429403770485     17.90363330765375      1.93977238375086
  H           7.24632332694117     17.11411716931978      2.62739949946551
  H           6.61443698403791     17.41883085258565      1.01796661817318
  H           6.08324791002094     18.40083183958037      2.38143283129786
  C           9.35933475695242     18.23196960274131      0.18774503780424
  H          10.17129654125908     18.84147454378203     -0.20599613713133
  H           8.71255964592094     17.96877608829389     -0.65234318002959
  H           9.80004090379499     17.30132204515422      0.55076527504260
  C           7.53625770792080     20.60701055138209      0.71529447727365
  H           6.85332992974297     21.13155848401219      1.38246659999159
  H           6.94777422245672     20.27111634111306     -0.14144227074711
  H           8.25351490860754     21.33896728400361      0.34331923634750
  C          11.24889231163599     21.10392189846750      0.83125000535554
  H          11.84391828375132     20.21985092128086      0.59582441780812
  H          11.90619890710455     21.96946607351028      0.71919809034558
  H          10.47425010434183     21.18960503759455      0.06928106791594
  C           9.74177016563023     22.71433747326283      2.90164584825769
  H           8.91925388926473     22.88200866521924      2.20483460211686
  H          10.45997223684089     23.52294328016819      2.75045541727501
  H           9.35119251648647     22.81796717248512      3.91379718107443
  C          12.17171569458546     21.00962096150044      3.65154986693270
  H          11.98846234073398     21.04422368020552      4.72340021221319
  H          12.79909473967443     21.87010339467154      3.40871930467913
  H          12.76190673154212     20.11525456780341      3.44228428020724
  C           5.15082997053545     21.89111765561451      4.33056326347202
  C           6.27648901180885     22.73433425001959      3.72324233328776
  H           6.78710141682529     23.34401537744758      4.46740560717266
  H           5.85377882559802     23.40735053222044      2.97401517072827
  H           7.03092224276977     22.12623362606598      3.22979940620151
  C           4.36787686661332     21.22965901112864      3.19293827535161
  H           4.98954933727302     20.54514145054830      2.61719946875662
  H           4.01519225877641     22.00424439226489      2.50856491700579
  H           3.49280068363197     20.68297040417624      3.53594519734215
  C           4.24733963964048     22.81319101388250      5.15041771786577
  H           3.36752140020289     22.31067216230337      5.54921311051947
  H           3.88994262776620     23.62089472958151      4.50804166228249
  H           4.77866798737439     23.28087783027572      5.98145683014438
  C           4.77827558736101     19.72902208493893      6.51711032800541
  C           3.44648478294480     19.41372072557656      5.83381218390217
  H           2.85405069741562     20.29993687028488      5.61300294334183
  H           2.84983025773287     18.79149671006692      6.50442243406609
  H           3.58438439839235     18.85081951789936      4.91041467546078
  C           4.54394638363908     20.55746494878162      7.78349445360958
  H           5.46677754050067     20.71337614969226      8.34270819010625
  H           3.85464406438646     20.02110145700029      8.43898736146776
  H           4.10103573621243     21.53264023044726      7.58228685651571
  C           5.42754757245578     18.39609754882899      6.89907528731258
  H           5.53401691257458     17.73485691138493      6.04095247193047
  H           4.79531167900295     17.89515640659041      7.63578189673198
  H           6.40880742652493     18.52301956536557      7.34721465915576
  C           7.24462619476939     21.44762278347847      6.32166294139774
  C           8.51103548983130     21.10381921651348      6.02161408626938
  C           9.62772678812444     21.85757666927218      6.60869580252112
  C          10.82610077111588     21.21485662388333      6.92221564293792
  H          10.93131318015628     20.15652060588788      6.71738430724952
  C          11.87849398254742     21.89935954946531      7.50654318750152
  H          12.78985929051660     21.37088881448285      7.75384188923533
  C          11.77017216521105     23.25935348559703      7.75536166700391
  H          12.59632981400048     23.80027454844382      8.19736002219767
  C          10.60062633782076     23.92468880474664      7.41620633805914
  H          10.51490682514493     24.99009561421024      7.58576112404219
  C           9.54165047210000     23.23076047135514      6.85527616143055
  H           8.64217176742397     23.76719528836181      6.57853329584899
  H           6.97981432492759     22.23299691355183      7.02641308776752
99
Cartesian coordinates (A) of atoms in GaOP-PhCCH-deprotonation optimized at the RKS-PBEh-3c level
  Ga          9.12321121718793     19.32677124114174      4.63788568655048
  P           6.33322861289602     20.86897650881535      5.54783547561155
  H           6.87008089894617     21.04795814100839      6.83565808567951
  Si          9.30041174528377     18.05974979332158      7.68706826227594
  Si         10.38475600207315     16.45445865677833      5.25238647340694
  Si          8.05838904586233     18.50863738141983      1.63244014124653
  Si         10.49229836732009     20.51419093532478      1.94779402547066
  O           7.27658491636463     20.12402750150302      4.59881657004078
  C           9.09904781390692     17.70660636913757      5.84724411072838
  H           8.12522736925093     17.20880625630903      5.72073065306785
  C           8.37255135172631     19.56149073517801      8.38973996263828
  H           8.66594880079574     20.49831907536191      7.91675421654216
  H           8.61863324853915     19.64312004886727      9.45145455161026
  H           7.28670614885853     19.46103617062684      8.33584705825360
  C          11.10349729243915     18.37652124709055      8.15941333993085
  H          11.50534402503187     19.21554285412046      7.58814706518634
  H          11.76003944443229     17.52206932464177      7.99606296376949
  H          11.17313597818499     18.63574282905953      9.21820666269841
  C           8.60218687389416     16.62342325411086      8.71083132532202
  H           8.65808683668608     16.84712822428149      9.77837712668242
  H           9.11869511326879     15.67909287808657      8.54855329344078
  H           7.54800698528056     16.45790962721696      8.47423049458745
  C          12.03707101031908     17.28237592219439      4.85356463395869
  H          12.77491072563257     16.53154842697126      4.56264205018421
  H          12.44288311596145     17.81877790623135      5.71168552402392
  H          11.97172783637753     18.00005483332519      4.03538657257454
  C          10.76454726482791     15.06455991463793      6.48812594963678
  H           9.87498665521112     14.47710082448988      6.72197427334579
  H          11.19017297027344     15.40645924372263      7.43135537657380
  H          11.48945253364655     14.38137737507183      6.03923983791767
  C           9.78662974047553     15.50981139195723      3.72479392755449
  H           8.85546518528029     14.97714888055552      3.92919723562393
  H          10.52755981664731     14.75906785684749      3.44151883350619
  H           9.61594050827079     16.13848819721257      2.85289277135211
  C           9.50398035721302     19.09266365599776      2.68174184283028
  H          10.20350456593005     18.24293415678959      2.64077409661412
  C           6.80056172341839     17.44651482649123      2.57276482715623
  H           7.26990956685984     16.71193444569683      3.22767023891453
  H           6.16816274492080     16.89876817873973      1.87080235130490
  H           6.14597020491195     18.06648678101537      3.18415769923835
  C           8.69070885329250     17.41863277907872      0.21722241401534
  H           9.37729248253747     17.94658292916332     -0.44432482973614
  H           7.86043342282269     17.05836785647740     -0.39409852205379
  H           9.21639232139640     16.53786604457877      0.59193876452937
  C           7.05199184095058     19.91485286563739      0.86480983456997
  H           6.57494895388622     20.52273699696330      1.63360638696965
  H           6.25829308759145     19.50512572463874      0.23638208154390
  H           7.64693293599123     20.58039229069573      0.23848653640658
  C          10.78500492857661     20.31473767177597      0.08361600923604
  H          11.29428109231594     19.37661168463040     -0.14446198149383
  H          11.42253837844111     21.12305012356397     -0.28160743169729
  H           9.86703924528417     20.33890776534160     -0.50533619054504
  C           9.65336431883966     22.19003708384127      2.19356031902953
  H           8.63426746484720     22.20514670224422      1.80497321494557
  H          10.20936861077179     22.97454916857080      1.67594899076936
  H           9.61730276226490     22.45668498447962      3.24980706598726
  C          12.21563947127925     20.59247296354436      2.71831978711874
  H          12.18131846969752     20.71590725022452      3.80088329055553
  H          12.78145012623617     21.43258287535681      2.30957016630897
  H          12.78902069270247     19.68799699683944      2.50446618750589
  C           6.05689748879374     22.60408645257413      4.98373800747581
  C           7.36057580907190     23.35240138885313      5.29269287925272
  H           7.56725026407144     23.40118946816358      6.36281483435192
  H           7.27416544468597     24.37730471851355      4.92620280160069
  H           8.22553535762184     22.89942275184611      4.81258230115786
  C           5.79477385343983     22.64005492556272      3.47906509610684
  H           6.63370043476877     22.23533024676130      2.91726668821220
  H           5.66339320589796     23.67811722622938      3.16721438801557
  H           4.89565980743720     22.09657522358797      3.18933392791879
  C           4.91257947619804     23.27300212136414      5.74430109829753
  H           3.93735504905110     22.85862203914362      5.49011350513273
  H           4.88952312161996     24.33132432318058      5.47752363596917
  H           5.04008431163617     23.22101652033645      6.82691131782563
  C           4.81912315250478     19.85769560741266      5.86512481613575
  C           3.88660911223365     19.87416159019888      4.65370282460266
  H           3.44099595158610     20.85451762007135      4.48368875804222
  H           3.06737247875582     19.17175414300817      4.81875902693681
  H           4.39696093921115     19.56786280530012      3.73966712039464
  C           4.09678591991710     20.34982439144396      7.12230792129580
  H           4.75859280699059     20.37941958306580      7.99015096045018
  H           3.28959275545519     19.65447858321356      7.36040356029976
  H           3.64715344786472     21.33299516565278      7.00628693472112
  C           5.30084861512582     18.42254217265015      6.11910441989015
  H           5.78710514218933     17.98373321778832      5.25135601497732
  H           4.43497867804389     17.80384303847650      6.36373641452677
  H           5.99391316153595     18.35653862827454      6.95873515910686
  C          10.01747651396640     20.83232530315315      5.52886133373554
  C          10.52112054335496     21.76349878684342      6.12696898131997
  C          11.08742004929644     22.86193945773388      6.83261476113555
  C          11.32316389342949     24.07729167031032      6.18405068886639
  H          11.08596552541765     24.16793027362922      5.13201034613562
  C          11.86079888128173     25.14857340499314      6.87688042860133
  H          12.04132084414066     26.08342933999091      6.36263719705393
  C          12.17257424052128     25.02485779550602      8.22372715322553
  H          12.59504704698103     25.86258788560106      8.76259028172118
  C          11.94431559160713     23.82074511044878      8.87560367414376
  H          12.18954185470187     23.71767515297817      9.92450505465947
  C          11.40597257607989     22.74626815456025      8.18863257153093
  H          11.22976257937924     21.80496908257877      8.69290543415555
101
Cartesian coordinates (A) of atoms in GaOP-TMSCCH-ring-closure optimized at the RKS-PBEh-3c level
  Ga         11.76868614440994      7.25608467581722      5.72493319147525
  P          11.00235045426090      6.24485081294272      8.46546490193179
  Si         15.05896161744941      7.56813679837614      5.13278516877159
  Si         13.71479296502935      4.70557423324395      4.99350006113593
  Si         10.61620894552307      7.35982528051209      2.63357854630445
  Si          8.80775855436856      8.68794629298505      4.76204697443829
  O          11.42850445806641      5.77890058508693      7.05933861705336
  C          13.47862619844943      6.57980094327689      4.86723389361140
  H          13.29780140560284      6.71109143388617      3.79033572056366
  C          15.31942203198230      8.08977268335079      6.93145592369427
  H          14.42217047197457      8.50550775600207      7.38876770557244
  H          16.10802781886766      8.84205811501926      7.00058810997184
  H          15.63196575055179      7.24355857124543      7.54585351761000
  C          15.07309380949710      9.09617826452476      4.01377329565581
  H          15.24961096170064      8.79620222404696      2.97838526643910
  H          15.88777356279402      9.76928614991966      4.29025074156636
  H          14.15195815992321      9.67402727331351      4.02427161625998
  C          16.67166896324039      6.69731597812301      4.63512916241564
  H          16.87141818700411      5.76602748285103      5.16426305260914
  H          17.50727378451322      7.37008732814294      4.84411723018550
  H          16.70054027811756      6.48061080278632      3.56638262442678
  C          14.66693779199172      4.10144611102126      3.46580039831231
  H          14.15146847775388      4.35303988636622      2.53670403611588
  H          14.75983512994147      3.01319690192236      3.49099781200763
  H          15.67416934941258      4.50937596292128      3.39702517597264
  C          12.11917614571789      3.67398498257182      5.00192081421273
  H          11.76754790056447      3.47588775807166      6.01284909653874
  H          12.30208363309213      2.71283166546932      4.51661230473795
  H          11.29985486557573      4.15253167001187      4.46540266264484
  C          14.71861953878554      4.15813326772913      6.50225704570173
  H          15.66297119524286      4.69120498096584      6.61400167640079
  H          14.95830858155711      3.09599574790337      6.41632073524458
  H          14.16257971672831      4.28475282573951      7.42883886983374
  C          10.14085070989870      7.37718108082712      4.46936247362018
  H           9.63789989824792      6.40806351895082      4.62821543255695
  C          11.92998413528356      8.65123564671106      2.20163745773805
  H          11.71513110536386      9.62564520781624      2.64298297825153
  H          11.97042291206693      8.79270214691029      1.11957710978145
  H          12.93037213794588      8.36850028511203      2.52248398222791
  C           9.19466054609077      7.69904206645779      1.41968366448419
  H           8.37790946700629      6.98352715303597      1.52138523029201
  H           9.58975931855400      7.59122062483133      0.40642545130653
  H           8.77035506631883      8.70049379837527      1.48881070416522
  C          11.21446293819829      5.65681749601906      2.06547926370522
  H          12.12883108701464      5.31470665274744      2.54382404941434
  H          11.40148266182931      5.67745435001511      0.98954378724843
  H          10.45305888771072      4.89423526236848      2.24185054091084
  C           7.14850144623126      8.18053536510257      3.99050633517033
  H           7.11407758143664      8.20788662808707      2.90474504853879
  H           6.36063960454903      8.84221471859267      4.35798146480472
  H           6.87936449974401      7.16709944192906      4.29896470040129
  C           8.24599851471820      9.05216659716225      6.54409485308755
  H           7.49121924996522      8.33777840037233      6.87549196370435
  H           7.76136465089611     10.03167612779494      6.54750026245709
  H           9.03638285168636      9.07897603522113      7.28758096997525
  C           9.33908117068549     10.36161168804378      4.05176977585856
  H          10.27502627464522     10.71176576284411      4.49146495812966
  H           8.58162618264228     11.11911824147508      4.26324272907749
  H           9.48078292326521     10.34336129929074      2.97105829984844
  C           8.54172083023470      5.66492113012689      7.43780492265264
  H           8.65385503343637      6.57639702873667      6.85912781981948
  H           7.47270291650871      5.50527284186592      7.59683953788587
  H           8.92104296973294      4.84104348063885      6.83540747200681
  C          12.18459780135031      5.64128433817841      9.76483260450875
  C          11.72614811779359      6.06726412027396     11.16146303231583
  H          11.59830036500257      7.14791147572473     11.24366366498561
  H          12.49052739110389      5.78256652604941     11.88767376993064
  H          10.79779601189150      5.59075769899507     11.47324838383590
  C          11.18829821815570      8.03233574840064      8.43136461196918
  C          11.65735686329687      8.58203398336376      7.29724926903484
  C          10.43902279533483     11.43491862303536      7.70990988567971
  H           9.81016319777514     11.44848120805898      6.82036287213672
  H          10.69689766101601     12.47011519504202      7.94379890565317
  H           9.83188633763781     11.05615762208323      8.53333383374595
  C          13.08236889039216     10.68148439192772      9.01206211444458
  H          12.56947304624375     10.35235789316256      9.91768218271718
  H          13.32429805712001     11.73753192892382      9.14717710160545
  H          14.02582036116520     10.13708695576343      8.95368714647445
  C          12.95241856256842     11.14794322454471      5.99658510716075
  H          13.97585686118159     10.77771482063418      5.94850522334937
  H          13.00454305927095     12.23536980732301      6.07803381158864
  H          12.47583357502983     10.92021912335900      5.04182002387710
  Si         12.02180288225199     10.43653383610287      7.46469050566057
  C           9.23881388875094      5.73656584262995      8.79982192796442
  C           9.10883791779214      4.35875722615328      9.45094060409844
  H           9.60289927616159      3.58026525307658      8.86997591136243
  H           8.04884580680919      4.09949517005420      9.49939421351826
  H           9.48932039532208      4.32471210170468     10.47037231313521
  C           8.56223024395489      6.79242932093318      9.67913555984360
  H           9.04300081812902      6.90362180043833     10.65196811879189
  H           7.52771962842162      6.49564345570375      9.86465427016128
  H           8.53812285239090      7.76976989188594      9.19824820932458
  C          12.36374726950494      4.12163096582705      9.69432109168644
  H          11.51087389530274      3.57593461205845     10.08923975938134
  H          13.23160331834787      3.83691042873954     10.29269870190890
  H          12.54399952424064      3.77499095359119      8.67747575905221
  C          13.53002677621456      6.31416215307486      9.47073161981532
  H          13.87593406507322      6.12231424274384      8.45770370557121
  H          14.28182443162352      5.91768245289927     10.15659680964883
  H          13.49311598028720      7.39415630057167      9.60646715582258
  H          10.99673129149117      8.58223390635748      9.35394174570017
101
Cartesian coordinates (A) of atoms in GaOP-TMSCCH-deprotonation optimized at the RKS-PBEh-3c level
  Ga         11.95487016069161      7.40290232765416      5.55359900189060
  P          10.92239061244241      6.52221154521278      8.58606231714239
  Si         15.17988941757818      7.38730134631649      5.18295786368025
  Si         13.63015035100168      4.62885830966561      4.97894490428557
  Si         10.58282273956950      7.48119633955387      2.66987111000697
  Si          8.96066181994076      8.70067691479035      5.02722244553305
  O          11.68663113870085      6.38785846833500      7.26617089561515
  C          13.57151732743506      6.49677842906785      4.78313295763456
  H          13.46362319251571      6.63275013808584      3.69549287144015
  C          15.44254951115259      7.62396086946175      7.03914881830245
  H          14.70624196438615      8.31190457431584      7.45468212388196
  H          16.43052069037463      8.04662017511696      7.23343377380887
  H          15.37982580802715      6.68357704675937      7.58837410866455
  C          15.22533835495374      9.08366448596475      4.35092755670496
  H          15.18920967855819      8.99496609098313      3.26304597991661
  H          16.15254012022699      9.60596141826468      4.59769389541325
  H          14.39632047716621      9.71961937335006      4.66149955215719
  C          16.70637230794366      6.47117954383312      4.52537403230102
  H          16.85642822831487      5.49157232143103      4.98138508976939
  H          17.60547791216546      7.05894716060276      4.72390281587325
  H          16.65211651883396      6.32344954557993      3.44523946047369
  C          14.51026835353818      3.85233367145256      3.49163082126731
  H          13.99688535689255      4.08328526326698      2.55585747798632
  H          14.53532624421956      2.76415280720522      3.58154804610922
  H          15.53964464376613      4.19470942140384      3.38771814475009
  C          11.92275246098249      3.80748334211298      5.04691168860956
  H          11.46405189682724      3.93829339002678      6.02624709214761
  H          12.01245628898250      2.73337940576558      4.87069401293362
  H          11.23191689428950      4.20176944944845      4.30129940332291
  C          14.52545502314968      4.05228019810376      6.54274409673531
  H          15.55106857887925      4.41601876027216      6.61344249234059
  H          14.56786870860528      2.96126919882281      6.56776789947021
  H          13.99728101559177      4.37658065112981      7.43946851267672
  C          10.21710154202903      7.38909456241462      4.52213079329507
  H           9.73987547397010      6.40958882815099      4.68008227879087
  C          11.87919890913983      8.80137608891999      2.28003552531296
  H          11.58511864175269      9.78427638144506      2.64895943899275
  H          12.01870093679578      8.88801310002075      1.20033535726097
  H          12.85599312610356      8.58190756814176      2.71204587929385
  C           9.07181701870734      7.86589218652945      1.58718512985802
  H           8.29703674293775      7.10430719953917      1.69167083071692
  H           9.37883571541013      7.86717579396281      0.53863430510455
  H           8.61065293823509      8.83301554322830      1.78609424234401
  C          11.17787086955873      5.81892104721133      1.98645607293675
  H          12.11422804506651      5.47032970487617      2.41825071177391
  H          11.32906540763130      5.89678023764970      0.90758038304565
  H          10.43357426729473      5.03624778926014      2.14791845691998
  C           7.21587408610542      8.15903313507653      4.51670536358850
  H           7.09243198359081      8.04166642030614      3.44145132525054
  H           6.47159578462392      8.88353723341843      4.85418394343209
  H           6.96025780901384      7.20069656381435      4.97606849884789
  C           8.76998721584931      9.04776888163772      6.88510681736983
  H           8.37581732359418      8.19778760852476      7.44580594240399
  H           8.04384552259591      9.85599877158748      7.00278110382434
  H           9.69999560586349      9.38136421325690      7.34506901338227
  C           9.35742700729529     10.39633378517666      4.29127151120061
  H          10.34471820112787     10.72629671935179      4.61979510912917
  H           8.63228648872648     11.13323583945262      4.64339248058751
  H           9.34175411190689     10.42420344676361      3.20201210076082
  C           8.96290655077713      5.08255620140028      7.38016566680621
  H           8.49096956863329      6.02241951009011      7.09031539485381
  H           8.17407455341649      4.33059227152392      7.44818237838651
  H           9.63419721247562      4.78663343033238      6.57782721619136
  C          12.08585879336172      6.73190045802077     10.00271952259999
  C          11.37852637280580      6.58378191493809     11.34906886135215
  H          10.51212994709758      7.24064605586432     11.44390047309876
  H          12.07640807289292      6.86131323592486     12.14136570861365
  H          11.06037095860788      5.56073062415555     11.54806493755937
  C          12.26214818090669      9.18096324110320      6.33798597017893
  C          12.41882822123665     10.30032138662744      6.79756184676509
  C          10.98820342878909     12.87086892977654      7.45882337511540
  H          10.54607627474036     12.90777886473553      6.46227311407640
  H          11.07383390623420     13.89639058777239      7.82220961773302
  H          10.28300528406555     12.34763972251577      8.10616407544969
  C          13.37750094606908     11.91244208714606      9.16519105902314
  H          12.69948213304642     11.40157098460460      9.85051318138863
  H          13.56530793465524     12.90776137307494      9.57161479440223
  H          14.32326830565225     11.36891761637779      9.17289960483135
  C          13.84741044993562     12.90119713034306      6.27744069984960
  H          14.80462480351768     12.38182336308227      6.21815661436804
  H          14.04149525104762     13.92033091082389      6.61619755907145
  H          13.44708224823265     12.95912465290813      5.26467409527597
  Si         12.65873671666938     12.00332393019988      7.42527737120975
  C           9.66921293720928      5.17391080787953      8.74001666052131
  C          10.34097449059946      3.83797652574696      9.05814433581914
  H          11.12134939787006      3.58961222994302      8.33771994716002
  H           9.59673807996424      3.04032447284301      9.01819360374526
  H          10.77971492335062      3.81958283118299     10.05610818087716
  C           8.62316808699037      5.53059720248223      9.79965914901586
  H           9.01830474109316      5.53771263619249     10.81260497380221
  H           7.82518741009952      4.78613563498715      9.77243261908430
  H           8.16039395611262      6.50081052848912      9.60837860664338
  C          13.24271130753623      5.74037328662508      9.89313955503373
  H          12.91879305637711      4.70084906407423      9.94200665349286
  H          13.93194273997145      5.90672981548057     10.72341204809301
  H          13.80353500703922      5.87994610540545      8.97178737506189
  C          12.62420973251407      8.16376367847236      9.88081612737592
  H          13.09259060621348      8.35961592531418      8.91805331635894
  H          13.37563610401061      8.32736448991267     10.65596919568520
  H          11.83910787347847      8.90870080492299     10.02037191296155
  H          10.14004886207045      7.68910484362884      8.65777872279709
