64
'1a
  Rh  -0.30200522759634     -2.13915285237760     14.78974778773511
  N   0.09261951463107     -2.28198117511791     12.76757510596804
  N   -1.04430190942598     -0.33747615761739     12.67588978222842
  N   0.99669917903446     -4.26288574650655     13.35114963709457
  N   -1.95435155830321      0.59289964057481     14.37498658337801
  N   0.97569525107529     -5.04242139674743     15.34432134341576
  C   -0.33995475616382     -1.32195963047209     11.96754374342047
  C   -0.77983888600440     -2.04797505121252     16.75843758655117
  C   -2.73221663516899     -3.20519874618181     15.94532029440269
  C   -2.07357266381987     -3.07296361034819     14.71438518831709
  C   -2.66078396596513     -3.57536174256997     13.56212348069796
  H   -2.17295812210122     -3.48606271561054     12.59798966130126
  C   -3.96943165593444     -3.84062954655708     15.99201857850973
  H   -4.48700811910194     -3.94771664923810     16.93836101340669
  C   -0.03198174547517     -1.47999272221010     17.78773387527118
  H   0.92688373391292     -1.01201340616566     17.58858391363380
  C   0.74557092279441     -5.21608481608921     16.77268605792528
  H   0.04032501220510     -6.03022946530426     16.93227427732461
  H   0.32732652956799     -4.29405011169419     17.16763939042857
  H   1.68813616680569     -5.43932206633313     17.27030881981878
  C   -4.55139199139756     -4.34096502999846     14.83820362545191
  H   -5.51441976544038     -4.83385752579354     14.88720525131615
  C   1.56694815309498     -6.00216934481167     14.53172035126849
  H   1.91764727637481     -6.94315593384893     14.91992720744435
  C   0.61834474723309     -3.96667639806732     14.64765429968315
  C   -0.11535595851448     -1.37675959416151     10.60435401522818
  H   -0.45909871280838     -0.60240922559301      9.93408912517478
  C   -2.26814666910773      1.36572756920774     13.26360222886396
  H   -2.87185336771276      2.25419998088145     13.33665988508023
  C   -1.20530246099848     -0.45580936387015     14.04392022177078
  C   -2.01426312174885     -2.63494827547115     17.09237403259742
  C   -0.48592292006699     -1.49166447891403     19.10313638158779
  H   0.11637856950713     -1.04242214319119     19.88435925915250
  C   0.71812646365050     -3.35662916841416     12.31757044944198
  C   1.58259559050798     -5.51682750879423     13.28037609608828
  H   1.94829778682724     -5.95036336722468     12.36648008235111
  C   -2.46642153938489     -2.64687347163106     18.40773173952414
  H   -3.41830876878322     -3.10306534532266     18.65529686890206
  C   -1.69836939430541      0.78594045484016     12.19545786847814
  H   -1.70815723333555      1.06881989695865     11.15778666779860
  C   -1.70370874520894     -2.07599065086603     19.41484321163991
  H   -2.05827077185656     -2.08710048387766     20.43806793989137
  C   -3.89757560676647     -4.20865041944127     13.62385681959692
  H   -4.34694471563461     -4.59818140042424     12.71795825901518
  C   0.56771974991685     -2.48893134769901     10.12716706103517
  H   0.76185458505513     -2.57050970125133      9.06521564630972
  C   0.99361067840250     -3.50765447643244     10.97093521783547
  H   1.50489932273119     -4.37667353989808     10.58311215922513
  C   -2.42539999042869      0.87871986986042     15.72392705201619
  H   -2.14473014353431      1.89368861260123     16.00120758325555
  H   -1.96667348457061      0.16780620548122     16.40599329187999
  H   -3.50815657856902      0.76981637147830     15.76350650035448
  C   3.24708861930910     -1.98361048066612     14.23958205676552
  H   3.75686301307653     -2.92140888222444     14.42711583525125
  C   2.42853172790891     -1.43087551893276     15.22840749278235
  C   1.79927721455571     -0.21142373910197     15.00286103822988
  C   1.98888030428528      0.45369353566331     13.78836553020568
  H   1.51803633446942      1.41583696094000     13.62359458688825
  C   3.41890280620350     -1.32882012472268     13.03750593183731
  H   4.06375678225654     -1.75092813013129     12.27615386411180
  C   2.78649391744790     -0.10459050529150     12.81075380383654
  H   2.94329270814377      0.41733463384478     11.87441001798246
  H   2.34360489642030     -1.91755205929807     16.19185221267025
  H   1.22237962782908      0.25725151138832     15.79026510935050
64
'1b_1,2
  Rh  -0.35682443489852     -2.12873114945412     14.80663751607733
  N   0.05555096371208     -2.26772216078656     12.78563182576026
  N   -1.10600050040893     -0.33745719609659     12.68545109941650
  N   1.00834435648253     -4.22134794386032     13.38437196210682
  N   -2.01498260845245      0.59921690658746     14.38219042245698
  N   1.05271280871988     -4.96340511407071     15.39154212354497
  C   -0.39705163890318     -1.32193836819151     11.97978541239078
  C   -0.85805599630078     -2.04952450416126     16.76999662295507
  C   -2.83081302184417     -3.13454835049460     15.91027634117833
  C   -2.12997119666211     -3.05045828219994     14.69920323509178
  C   -2.68735701175117     -3.56803962604064     13.53950189382275
  H   -2.16396639764107     -3.51967073603684     12.59157109823971
  C   -4.08712884805929     -3.73276221965719     15.92764885932595
  H   -4.63823208804859     -3.80344822989822     16.85825844219124
  C   -0.09953844884349     -1.54121992927846     17.82237987304186
  H   0.90284820738853     -1.16334544360438     17.65572938563185
  C   0.88328160011669     -5.10518543316196     16.83203599502685
  H   0.36072297609541     -6.03612817698378     17.04514459236827
  H   0.29698548490042     -4.26424701662939     17.19144003423676
  H   1.85856154697573     -5.10392124300410     17.31608753745000
  C   -4.64331107319019     -4.24525267060354     14.76651253512160
  H   -5.62115192217414     -4.70972718798990     14.79365593547446
  C   1.69425357978521     -5.89903361671294     14.59110259046504
  H   2.10500531510323     -6.80945390878899     14.99299327075523
  C   0.62497741003121     -3.92436915143676     14.68040501007113
  C   -0.18018028785284     -1.38533364173205     10.61618541059389
  H   -0.54178234908670     -0.62398055950469      9.94045167161587
  C   -2.33923190966753      1.36139692162087     13.26704430899395
  H   -2.94768656293225      2.24693213334835     13.33631236815248
  C   -1.26201831073773     -0.44790373456045     14.05526400041868
  C   -2.12675619103547     -2.57696392344186     17.07134304672308
  C   -0.58929483698325     -1.52998022150335     19.12461106879086
  H   0.02173811337757     -1.12878657899524     19.92492524811542
  C   0.69972436880446     -3.33420338686443     12.34314247831844
  C   1.66842447859667     -5.43808693694425     13.33019690792054
  H   2.04959960228142     -5.86721309001639     12.42056344417564
  C   -2.61530734386690     -2.56447141936327     18.37377416157561
  H   -3.59483684725030     -2.97290151886458     18.59537152877290
  C   -1.77042635464205      0.77755824737513     12.20018831912803
  H   -1.78678542739705      1.05352924446727     11.16072976441726
  C   -1.85032694171695     -2.03558227826048     19.40133474307244
  H   -2.23219979921619     -2.02698765703359     20.41469239411085
  C   -3.94287627739766     -4.16607563082227     13.57396817564719
  H   -4.36985865986870     -4.56902977126068     12.66320995439247
  C   0.51957799056983     -2.49049689971786     10.14521999306110
  H   0.70776235894343     -2.57912080132855      9.08277782254102
  C   0.96999979422795     -3.49253651287569     10.99569491763492
  H   1.49490739799837     -4.35565602350118     10.61297302273948
  C   -2.48311720500979      0.89014527505618     15.73160055989604
  H   -2.21524593403758      1.91134071962955     15.99803312877034
  H   -2.01150461369100      0.19132926754306     16.41731528262712
  H   -3.56398272536320      0.76612387386991     15.77718883253522
  C   3.53399328250552     -2.06368941981524     14.02771016139415
  H   4.13954809167871     -2.95711379405576     14.10974066805512
  C   2.80723642114595     -1.62938743902438     15.12295133400267
  C   2.02377946724692     -0.48776252714182     15.08490442769712
  C   2.00195825364624      0.25655206321320     13.90615207059462
  H   1.42390185420782      1.17225482982388     13.87241552622267
  C   3.48179677840419     -1.31816454984865     12.86257178265094
  H   4.05682750759198     -1.63633529253454     12.00155095588602
  C   2.72082704261070     -0.15454235900173     12.79850600534986
  H   2.70893269886916      0.43574181611982     11.89121539587834
  F   2.89615744867535     -2.32522923246795     16.26559128585837
  H   1.51779656423809     -0.14287843903096     15.97669421746779
64
'1b_2,3
  Rh  -0.29330091737168     -2.14169067841269     14.79012640570927
  N   0.09972598228229     -2.28619639913092     12.76688572231349
  N   -1.03639089355197     -0.34074212347511     12.67631930478506
  N   0.99667325730581     -4.27169098321570     13.34834253903317
  N   -1.94731488131548      0.58891797678592     14.37537429179711
  N   0.97730158228709     -5.05108506749307     15.34110314092197
  C   -0.33661133008275     -1.32787740755863     11.96674396221418
  C   -0.77481914503264     -2.04813804795363     16.75790211003974
  C   -2.72267113487461     -3.21132280327499     15.94211889609446
  C   -2.06463458120144     -3.07582289279622     14.71136677004236
  C   -2.65121163449737     -3.57597165187274     13.55794037721181
  H   -2.16391016376663     -3.48445371812822     12.59383200847530
  C   -3.95931663302289     -3.84799364745814     15.98736105641723
  H   -4.47672444215635     -3.95747607940369     16.93346093741584
  C   -0.03374852205070     -1.47212833675394     17.78757972672657
  H   0.92034456049875     -0.99358399121901     17.59007723280070
  C   0.76413042810742     -5.21896431667274     16.77237210561312
  H   0.07148023147628     -6.04144689926406     16.94383663190089
  H   0.33777523562245     -4.30039094402828     17.16652176640747
  H   1.71512081079457     -5.42650011469484     17.26052380600786
  C   -4.54095313424467     -4.34616511779456     14.83253017314319
  H   -5.50351479583420     -4.83996661839589     14.88043948222310
  C   1.55651208304521     -6.01561487377260     14.52595060471122
  H   1.90687093583794     -6.95660659645373     14.91403545222284
  C   0.62544415116581     -3.97350292452918     14.64691512911622
  C   -0.12249265053767     -1.38778343710367     10.60203631111501
  H   -0.46925429909005     -0.61483589467495      9.93174677233476
  C   -2.26301568703279      1.36052642173502     13.26374086286451
  H   -2.86825920676877      2.24796172616641     13.33650135211717
  C   -1.19658607919638     -0.45880598221485     14.04439071707992
  C   -2.00706158070949     -2.64045460602442     17.09025616563852
  C   -0.48948713827260     -1.48502349317320     19.10236824854531
  H   0.10817221599625     -1.03018446309594     19.88382580216707
  C   0.71477875831424     -3.36710131505493     12.31532080908377
  C   1.57029306648994     -5.53144627009065     13.27500810108965
  H   1.93443060781327     -5.96546400451782     12.36091949469186
  C   -2.46115395895303     -2.65375569864930     18.40488031121527
  H   -3.41105784890677     -3.11465309508499     18.65113714754417
  C   -1.69288330932995      0.78109114792621     12.19560607352941
  H   -1.70389915656934      1.06342124233736     11.15781491930498
  C   -1.70339566856863     -2.07780040631519     19.41285073130523
  H   -2.05932635620446     -2.09049767315555     20.43552028561659
  C   -3.88742321302387     -4.21039352483607     13.61842514076818
  H   -4.33654010295571     -4.59816516124248     12.71171150734149
  C   0.55173407936024     -2.50485792034546     10.12326405212546
  H   0.73671600526128     -2.59105750337037      9.06005047983298
  C   0.97830727335614     -3.52353023393698     10.96669803223407
  H   1.48074736195572     -4.39715510508275     10.57779536564150
  C   -2.42039229742885      0.87410309645615     15.72380739408607
  H   -2.14062504792491      1.88907783461407     16.00199671996262
  H   -1.96294742987057      0.16294801534973     16.40642305342619
  H   -3.50317876610122      0.76512831874508     15.76147431773703
  C   3.17745119395015     -1.93359808577918     14.23961247842603
  F   3.75186747088057     -3.12502621500362     14.46806636030133
  C   2.38146220413570     -1.38493908599280     15.23957257078778
  C   1.79615228719809     -0.14506190130659     15.00749811596977
  C   2.00453373754821      0.51548303017523     13.79562741272102
  H   1.55960707969643      1.48855486979294     13.62954217466877
  C   3.39172065757097     -1.30546707469576     13.03698025660878
  H   4.03007996910478     -1.76687482977880     12.29482248844206
  C   2.79347941713733     -0.06423901105903     12.82156533114010
  H   2.96935737064208      0.45236043729508     11.88603576869133
  H   2.30619326164982     -1.88720526694491     16.19484121943814
  H   1.22556872996362      0.33190537490361     15.79427602106199
64
'1b_3,4
  Rh  -0.32305465654001     -2.13214472145010     14.79411058593206
  N   0.07913649736618     -2.27043405974326     12.77243558297624
  N   -1.06310857912422     -0.32900969141755     12.67952650393612
  N   1.00328509708688     -4.24161760173399     13.35842861880069
  N   -1.99168230147695      0.58982201474210     14.37499997415255
  N   0.97203557771772     -5.02866187282593     15.34837732701362
  C   -0.34510379309333     -1.30615443080996     11.97318579466633
  C   -0.79324144611412     -2.04130803266128     16.76314283967420
  C   -2.74666365608218     -3.20028115249058     15.95716823201085
  C   -2.09108675212945     -3.06917569898271     14.72461704963033
  C   -2.67800432554701     -3.57322981770126     13.57336030395433
  H   -2.19027955581507     -3.48449343772341     12.60918468656929
  C   -3.98313331809153     -3.83703919542419     16.00609999432963
  H   -4.49909166576672     -3.94395555176349     16.95331807036608
  C   -0.03997976438834     -1.47454371312485     17.78891024261486
  H   0.91830369857353     -1.00704679295271     17.58524713855671
  C   0.72802601639643     -5.21142642204763     16.77340700422464
  H   0.02614164430173     -6.03067123493444     16.92111709298464
  H   0.30058479411464     -4.29410573264228     17.16934487310242
  H   1.66663325389091     -5.43240661239902     17.27940292377021
  C   -4.56595364635180     -4.33908178919137     14.85342394646364
  H   -5.52828953698681     -4.83303119562870     14.90419270990333
  C   1.58268033370448     -5.97823185137641     14.53807377291592
  H   1.94052299403036     -6.91658756507549     14.92607901432755
  C   0.60955041176938     -3.95418152192318     14.65233798592264
  C   -0.09074961700453     -1.34490132822118     10.61490111059415
  H   -0.42645738665693     -0.56664547016572      9.94506038452487
  C   -2.30839128511198      1.36023425277503     13.26291814523492
  H   -2.92228817571928      2.24188476944239     13.33359465810734
  C   -1.23020568735686     -0.45073811164946     14.04666509490665
  C   -2.02588787326269     -2.62899044694102     17.10196382312528
  C   -0.48783346223815     -1.48713516504017     19.10641157514010
  H   0.11799509662390     -1.03896364207392     19.88545376293609
  C   0.72998278157790     -3.33190786333871     12.32581685116328
  C   1.60556721099759     -5.48766643250242     13.28876432374478
  H   1.98733252562289     -5.91214822283217     12.37719093116925
  C   -2.47213363413387     -2.64159224779788     18.41930298003356
  H   -3.42269574897688     -3.09822143010657     18.67102774110067
  C   -1.72696032814620      0.78774971724688     12.19695714099880
  H   -1.73591278667265      1.07090532120413     11.15932872776076
  C   -1.70455018513091     -2.07123164826823     19.42308439339293
  H   -2.05431983428211     -2.08282037564292     20.44790270155636
  C   -3.91402032596315     -4.20773258444108     13.63785723676743
  H   -4.36420741481322     -4.59918223044062     12.73326540153698
  C   0.61926907620680     -2.44257499730789     10.14240538937511
  H   0.84330623863336     -2.50807852841535      9.08535098452775
  C   1.04022289593226     -3.46399609269029     10.98511374260212
  H   1.58283424546752     -4.31573992277414     10.60205105358881
  C   -2.47567837541765      0.86655698281865     15.72144574460255
  H   -2.21094383896350      1.88469939379909     16.00249926027147
  H   -2.01182829110806      0.16058528753081     16.40512998288391
  H   -3.55705530737271      0.74262635312964     15.75312239514914
  C   3.27217933663797     -2.02276079569542     14.23017487770786
  H   3.79207374345965     -2.95935151348431     14.38597918760831
  C   2.47434400838632     -1.45407796516044     15.22370274409814
  C   1.83560262209522     -0.23920345695368     15.00175263388845
  C   2.00914647220652      0.42000583885413     13.78170385029510
  H   1.53842779585597      1.38190619451768     13.61755854690847
  C   3.39777459429869     -1.36131294895718     13.03214679771744
  F   4.14172533364101     -1.90915690180366     12.06008886255625
  C   2.78432590945428     -0.13887960543647     12.78719185790932
  H   2.94038386361550      0.35413736620681     11.83637848126672
  H   2.40110488700375     -1.93960880014243     16.18854397779317
  H   1.27022359916953      0.23309493203979     15.79437037665677
64
'1c_1,2
  Rh  -0.40354976824446     -2.18046757223730     14.83974032315690
  N   0.05408033607143     -2.29119202164753     12.82266985053529
  N   -1.06106971611490     -0.33306769720337     12.73714809146466
  N   0.97391819452976     -4.26369003072838     13.41343621535357
  N   -1.92936812976582      0.62499910487602     14.44376825279574
  N   1.01231527087189     -5.01460161550221     15.41794182565660
  C   -0.37953299618033     -1.33133378388221     12.02369130758689
  C   -0.92825556674222     -2.11885258545246     16.78693268345080
  C   -2.85748546888929     -3.25529659868410     15.91263871755739
  C   -2.16773157312678     -3.10805016686350     14.70086608729468
  C   -2.71697364519714     -3.58572618985957     13.52173281811240
  H   -2.20071095448216     -3.48195129902114     12.57450415386738
  C   -4.09793308438235     -3.88544189927225     15.90974905573499
  H   -4.64293045401642     -4.00477194717371     16.83899824081318
  C   -0.18852430707255     -1.56342184351051     17.82687916236944
  H   0.77185904534653     -1.09922275288825     17.63470457663997
  C   0.82928356788033     -5.16539585180579     16.85656440529163
  H   0.28879618755361     -6.08860302018914     17.05819835546208
  H   0.25456308537088     -4.31749116793818     17.21900660091413
  H   1.80063727859937     -5.18703063972799     17.34817183462049
  C   -4.64732574751178     -4.36324960664825     14.73038808497944
  H   -5.61348325666783     -4.85212237473510     14.74264066721410
  C   1.65821057809383     -5.94569349914410     14.61604813638027
  H   2.06939832792642     -6.85721920053143     15.01514709965432
  C   0.58306124580239     -3.97407330647807     14.70906380110147
  C   -0.17003535378224     -1.39482858287497     10.65839391173787
  H   -0.51855825627985     -0.62389205347184      9.98661584308831
  C   -2.19310934069669      1.42679988084932     13.34166323455998
  H   -2.74632138663563      2.34692235394886     13.42262973264168
  C   -1.23831172405264     -0.45956906431493     14.10383726503220
  C   -2.16789708659969     -2.70688401229213     17.08631758336055
  C   -0.66700169184921     -1.59343364568491     19.13296734780999
  H   -0.07788053885728     -1.15662703851631     19.93110040018578
  C   0.67400827495318     -3.36913219805139     12.37417664265330
  C   1.63612709385913     -5.47891274690339     13.35680907984432
  H   2.02253086687768     -5.90339930048727     12.44711797919787
  C   -2.64280074885325     -2.73630920745871     18.39360330801305
  H   -3.59930069470298     -3.19360087160377     18.62075934620439
  C   -1.65039771742080      0.82947362254477     12.26806584612495
  H   -1.63834161346287      1.12676265303149     11.23440037375617
  C   -1.89205544810303     -2.17994471396120     19.41753768741567
  H   -2.26146657796810     -2.20352291307555     20.43534350682192
  C   -3.95812326367728     -4.21458041798821     13.53813666834370
  H   -4.38217256498709     -4.58677723245276     12.61308259856558
  C   0.50113415272251     -2.51438194666883     10.18049393361962
  H   0.68039702333137     -2.60456527366380      9.11661195750151
  C   0.93384122905313     -3.52966904294587     11.02543426572120
  H   1.43558263709746     -4.40367337024187     10.63627597079241
  C   -2.37637327312891      0.92831704924960     15.79802737749687
  H   -1.99457008332233      1.90300868502158     16.09728919861460
  H   -1.99146438739639      0.16209773416414     16.46541874165503
  H   -3.46467677413930      0.92838882624550     15.83026322817446
  C   3.41348157571680     -1.94748105338272     14.08977132537652
  H   3.91715002041684     -2.88292684252688     14.29931028810376
  C   2.79585010470543     -1.27986264627823     15.13112524544354
  C   2.16534175959519     -0.06205828303083     14.90763090653415
  C   2.14902333623390      0.49268822741609     13.64122552645249
  H   1.67037281106604      1.45406599269766     13.50237361580886
  C   3.39714415483486     -1.39294571743911     12.82020479654064
  H   3.89617566019773     -1.90449100529948     12.00727075660579
  C   2.76642344949337     -0.17595070811836     12.59649141189339
  H   2.77114220930597      0.26553855177217     11.60827010189348
  F   2.84173159759582     -1.78334953647419     16.36680852996929
  F   1.61227211920673      0.59360341451487     15.93077411843728
64
'1c_2,3
  Rh  -0.34759834213870     -2.14092681668486     14.81405077260296
  N   0.07402864030406     -2.28185508766702     12.79397579695738
  N   -1.08493527243495     -0.35011810971403     12.68849311689863
  N   1.01681992862052     -4.24032624750513     13.39603226219503
  N   -1.99753063979896      0.59023796519103     14.38117951817423
  N   1.04083194871889     -4.98829903251159     15.40096335397737
  C   -0.37697283521563     -1.33738515685906     11.98563816973043
  C   -0.85294444512438     -2.05664960528448     16.77448998725951
  C   -2.82279987646522     -3.14454210523073     15.91488603050454
  C   -2.12004521052437     -3.06249086207385     14.70485613596543
  C   -2.67388805976087     -3.58160197978424     13.54440586828085
  H   -2.14815658172440     -3.53443499619761     12.59777489218839
  C   -4.07901601979814     -3.74298422146075     15.93021055494438
  H   -4.63209921727757     -3.81224909031567     16.85975567396595
  C   -0.09630252272056     -1.54223858704884     17.82491571507772
  H   0.90521064899073     -1.16251501418271     17.65700898680027
  C   0.86685388531218     -5.13120282206692     16.84061944166413
  H   0.32726284046031     -6.05318039148710     17.05019738942351
  H   0.29523428612155     -4.28114779418915     17.20231201734058
  H   1.84179728353019     -5.15018238086715     17.32502801324679
  C   -4.63243294635153     -4.25714983549447     14.76850567929270
  H   -5.61029912175550     -4.72162821630625     14.79413106008034
  C   1.66794536589930     -5.93349679188839     14.59983265276299
  H   2.06793457965897     -6.84842021105204     15.00201757700424
  C   0.63185736545014     -3.94130825432401     14.69186621787457
  C   -0.16251309459272     -1.40607632164030     10.62180909277243
  H   -0.52341281993831     -0.64629685311828      9.94392102380989
  C   -2.31338730113382      1.35399172007569     13.26472747296522
  H   -2.91843516874507      2.24207651265087     13.33128337322397
  C   -1.24737071619723     -0.45995782178564     14.05743767214829
  C   -2.12135418330033     -2.58399086055259     17.07588499094512
  C   -0.58740746157438     -1.52643622929272     19.12663455008082
  H   0.02211888462857     -1.12108246985473     19.92597792931824
  C   0.71152604969810     -3.35395468913959     12.35360659551980
  C   1.65409354871122     -5.46974845262835     13.34076125804976
  H   2.03956095283562     -5.89861926636278     12.43301284028934
  C   -2.61129444781415     -2.56716000238473     18.37770547638882
  H   -3.59064078354370     -2.97579584089949     18.59969763140271
  C   -1.74219795229103      0.76777612277715     12.20039278469002
  H   -1.75279019555525      1.04388440318190     11.16088076288758
  C   -1.84785112329805     -2.03324031316682     19.40389147840471
  H   -2.23059555436530     -2.02131463276317     20.41686329513659
  C   -3.92948773550005     -4.17973799834413     13.57734167068708
  H   -4.35461086911731     -4.58405982678049     12.66634722975519
  C   0.53176865477503     -2.51587642667634     10.15334298012913
  H   0.71721735297246     -2.60911919021407      9.09078588847881
  C   0.97863620758828     -3.51768248733705     11.00609959488509
  H   1.49840314048115     -4.38481146616712     10.62547370952094
  C   -2.47143497908505      0.88263122911321     15.72831458577836
  H   -2.20038318474266      1.90249177445317     15.99670808838879
  H   -2.00664656850334      0.18138038770497     16.41619264551213
  H   -3.55307755600975      0.76370693715457     15.76810343832403
  C   3.44474470926762     -1.99513789486454     14.00234123054735
  F   4.13316467015134     -3.13739954948598     14.06104570130955
  C   2.76405815959512     -1.56286040479733     15.13569791841850
  C   2.02408692498142     -0.39515931551296     15.10221638265186
  C   1.99544975543443      0.35463074765151     13.92678804571260
  H   1.44191211827613      1.28488887345035     13.90737165935146
  C   3.40880644325908     -1.25909572396025     12.84049327261913
  H   3.96276192272839     -1.61316085953110     11.98039249295844
  C   2.68263594478074     -0.07211005806740     12.80644080227785
  H   2.67242837612168      0.52024168187021     11.90070180518422
  F   2.87343831829984     -2.27222768903025     16.25948241545436
  H   1.54202387874524     -0.04487210072040     16.00536332980887
64
'1c_3,4
  Rh  -0.31416210556697     -2.13749004242184     14.79523099656309
  N   0.08711120612209     -2.27566444187792     12.77250801964004
  N   -1.04941824494326     -0.33035140313995     12.68277053807632
  N   1.00132888589796     -4.25353972565544     13.35409517034537
  N   -1.97827735844680      0.58735275087290     14.37866923215664
  N   0.96315434250150     -5.04574650235524     15.34142772739211
  C   -0.33667083264011     -1.31012280377921     11.97444394434737
  C   -0.78727165208866     -2.04351452995996     16.76337851969744
  C   -2.73455389592373     -3.21229099210775     15.95668457903023
  C   -2.08141179113315     -3.07519066371397     14.72364908574044
  C   -2.66788744631790     -3.57641895201930     13.57111991155980
  H   -2.18180546329765     -3.48291324875183     12.60663667567023
  C   -3.96896086235131     -3.85308983917691     16.00478808464921
  H   -4.48344448627415     -3.96480447835108     16.95223335564060
  C   -0.04175759708338     -1.46513531573139     17.78831337686705
  H   0.90960343819339     -0.98341726550326     17.58428182785439
  C   0.73426155132189     -5.22440161042442     16.76907352933368
  H   0.04665001707070     -6.05379320933171     16.92680348355043
  H   0.29592400148562     -4.31182168454531     17.16398512657130
  H   1.68096288178293     -5.42762007828689     17.26732756153662
  C   -4.55167787787109     -4.35273508818718     14.85105997470382
  H   -5.51239446734063     -4.84985122657185     14.90128425480023
  C   1.55664272274041     -6.00211361012076     14.52669037548602
  H   1.90788569022604     -6.94359912854015     14.91276228131030
  C   0.61394622753073     -3.96525953544131     14.65037695589203
  C   -0.08989264086653     -1.35155513309386     10.61479098052063
  H   -0.42539354488359     -0.57244060055857      9.94584782992247
  C   -2.29294428683417      1.35968084211859     13.26738916448938
  H   -2.90574642831772      2.24204549983311     13.33877149045192
  C   -1.21783082535108     -0.45387018885379     14.04950627740157
  C   -2.01605277879758     -2.63925427877938     17.10198871760060
  C   -0.49030683819590     -1.47912207342449     19.10555141002128
  H   0.10989716902540     -1.02236456409869     19.88391535583606
  C   0.72752921153367     -3.34317121281214     12.32322218011357
  C   1.58289200610700     -5.50946601247128     13.27922458949873
  H   1.96223337048366     -5.93407572182921     12.36689113119720
  C   -2.46303525667751     -2.65352431349515     18.41899380787389
  H   -3.41024658003967     -3.11706275612507     18.67065179345598
  C   -1.71149770822734      0.78776786221117     12.20113440021924
  H   -1.71945493249133      1.07221422638104     11.16384830578120
  C   -1.70104961744291     -2.07518526602134     19.42248787753362
  H   -2.05126148087868     -2.08859598308844     20.44710900495170
  C   -3.90197172505734     -4.21467840656856     13.63506859815620
  H   -4.35223320416492     -4.60402360092788     12.72963181794714
  C   0.60998002903437     -2.45467802992217     10.13944315936576
  H   0.82679223935336     -2.52310584676002      9.08103811177345
  C   1.02838891702804     -3.47847071114087     10.98048853685170
  H   1.56171429647214     -4.33507904233150     10.59529791619582
  C   -2.46485002731424      0.86278420431388     15.72451593703014
  H   -2.20095478035514      1.88077623871934     16.00693914087754
  H   -2.00254917336367      0.15625190722287     16.40863827554719
  H   -3.54628700152529      0.73886973374587     15.75387091907785
  C   3.20279043733269     -1.98831369158419     14.24919942153074
  F   3.77348579273258     -3.17580387066314     14.46431270774429
  C   2.42576615439304     -1.40571808791366     15.24028336545631
  C   1.83907514635440     -0.16793460073940     15.00030784214149
  C   2.03983927874025      0.47534587565277     13.77932709621821
  H   1.60208614537225      1.44972170960827     13.60351946673488
  C   3.37967077069216     -1.35890937999561     13.03415184105079
  F   4.10736765190295     -1.95351879079870     12.08721908788304
  C   2.80459660503314     -0.11992848280425     12.79523860304212
  H   2.98202516852438      0.35877848353075     11.84054513896143
  H   2.34889435121398     -1.90012086265876     16.19997587011795
  H   1.27861720586069      0.32065755124417     15.78644824101215
64
'1c_4,5
  Rh  -0.32438774289289     -2.14960690652255     14.79785217724269
  N   0.08294787375305     -2.28880693417446     12.77660650319577
  N   -1.04143800284991     -0.33670531868167     12.68314862537133
  N   0.99885592715605     -4.26362890719608     13.36389824624283
  N   -1.98421995034537      0.57736157495997     14.37316762188450
  N   0.95064613073434     -5.05590664139475     15.35151859103911
  C   -0.31845322900903     -1.31254631065681     11.97925802312367
  C   -0.78919072130687     -2.05043131105127     16.76682793498178
  C   -2.74889564668075     -3.20391983184361     15.96958697247737
  C   -2.09620728828586     -3.07802866378410     14.73504085674272
  C   -2.68687105152093     -3.58128835053851     13.58561581202619
  H   -2.20050166528278     -3.49501038657892     12.62055375862628
  C   -3.98748549467550     -3.83626295196738     16.02231727183594
  H   -4.50179914910864     -3.93964625149994     16.97082680419246
  C   -0.03092924099345     -1.48205900026348     17.78774562417255
  H   0.92854127431128     -1.01879935509732     17.57933123399393
  C   0.69618777785706     -5.24048645220662     16.77463284883605
  H   -0.02048515398852     -6.04810316957592     16.91518835392180
  H   0.28246437012199     -4.31756998934761     17.17215168059489
  H   1.62825078987258     -5.47962276587852     17.28435632903587
  C   -4.57451003895807     -4.33811716980492     14.87167057916726
  H   -5.53852956279461     -4.82842700375995     14.92543119168319
  C   1.55400268564230     -6.00992010946150     14.54118378163955
  H   1.89941789251977     -6.95348808512924     14.92785034267827
  C   0.60191920961154     -3.97597569598985     14.65684075622875
  C   -0.03363772323868     -1.33614651954519     10.62699105582585
  H   -0.33965558661705     -0.54262649107130      9.96111494931566
  C   -2.28611363199713      1.35444176347674     13.26149319497316
  H   -2.89754812957083      2.23798410066024     13.32985507106389
  C   -1.22268072040676     -0.46415202766661     14.04786164779209
  C   -2.02316433316582     -2.63203701112173     17.11104150684760
  C   -0.47501660025865     -1.48764086596224     19.10661405770356
  H   0.13454582877920     -1.03854485261945     19.88217873994728
  C   0.73844446618926     -3.34824556172013     12.33194929264496
  C   1.58748703416194     -5.51618955352623     13.29324598348181
  H   1.96673372493995     -5.94317144808063     12.38173496236251
  C   -2.46572414278475     -2.63761326847668     18.42961206674051
  H   -3.41739485302279     -3.08937406952862     18.68587993290841
  C   -1.69504217492352      0.78525329514035     12.19898364461575
  H   -1.68999321805770      1.07420316475942     11.16290472400943
  C   -1.69297745782574     -2.06607243484254     19.42888144696598
  H   -2.03986034063933     -2.07215204344484     20.45470890881628
  C   -3.92505363339048     -4.21114516549625     13.65424665542935
  H   -4.37902534257761     -4.60220386411559     12.75140667566145
  C   0.67829256812753     -2.43341341170922     10.15693489097231
  H   0.92841268979902     -2.48557081165772      9.10509907287338
  C   1.07328966464904     -3.46837248328455     10.99630977969318
  H   1.62036375457660     -4.31803960740124     10.61486163871493
  C   -2.48366904607089      0.84805009830521     15.71527287323824
  H   -2.23172507486089      1.86856839268347     15.99931483902390
  H   -2.01957859069418      0.14608419907940     16.40291718852144
  H   -3.56404347773915      0.71357170038963     15.73655952527515
  C   3.25522595667907     -1.98140180708933     14.19082273736019
  H   3.77702047962315     -2.91899073103070     14.33543875510365
  C   2.46699893774389     -1.41975172442138     15.19770949785352
  C   1.83381208657283     -0.20154620180819     14.98881873159973
  C   1.98284690477006      0.46584430095847     13.77121334759144
  H   1.51728450187811      1.42646587230751     13.59020320466099
  C   3.37645598442655     -1.32969684639283     12.98924186636333
  F   4.10097949057897     -1.85586759999046     12.00122424610641
  C   2.74021165773345     -0.10537896685476     12.77950431607931
  F   2.87903711270592      0.49814096458544     11.59872169737165
  H   2.40581823275725     -1.90986159463862     16.16032531769171
  H   1.27447300826339      0.26784509859616     15.78727003586514
64
'1d_1,2
  Rh  -0.32366534226585     -2.17330145837821     14.81291972213754
  N   0.08034298048474     -2.30330713375091     12.78890855308413
  N   -1.01819959418392     -0.33543262012457     12.71339908258059
  N   0.95999623735942     -4.29942076182934     13.36155806129336
  N   -1.87441098298569      0.62132137073243     14.42603831669177
  N   0.95883574094937     -5.07857389836544     15.35482119199640
  C   -0.34592743100798     -1.33514810696952     11.99523185161750
  C   -0.82336678121676     -2.09956743756577     16.77709797610545
  C   -2.72644412444505     -3.31733931834005     15.93760665669409
  C   -2.08298874767748     -3.12186240674553     14.70784414431231
  C   -2.66495035513666     -3.59106525876224     13.53974054237374
  H   -2.19019374078763     -3.44948166765339     12.57574736515198
  C   -3.94481536211304     -3.98888509038260     15.96719807295933
  H   -4.45241252976684     -4.14408569330966     16.91215930523486
  C   -0.12098283787950     -1.48782380356427     17.81342196767480
  H   0.78677163075639     -0.92762435823279     17.61944640230469
  C   0.75988741886764     -5.24647198119872     16.78847608889113
  H   0.06127687371415     -6.06254050964511     16.96626698581204
  H   0.34710481883959     -4.32441244583400     17.18872330135487
  H   1.71461870917308     -5.46359136600767     17.26481072801864
  C   -4.52196631682189     -4.46037157577377     14.79901179573526
  H   -5.47068579059142     -4.98115868953244     14.83545005505638
  C   1.53382589620574     -6.04119505595195     14.53555081996032
  H   1.88928514357474     -6.98149237895740     14.92079606638130
  C   0.59830429951901     -4.00209727360971     14.66359436721648
  C   -0.14426811337379     -1.39610593068184     10.62827353023944
  H   -0.48471125420712     -0.61665699598545      9.96225610292408
  C   -2.15511824154078      1.41843234742473     13.32449796358643
  H   -2.71437932863420      2.33450946936922     13.40919099286627
  C   -1.17830914261633     -0.45848573680144     14.08231258175194
  C   -2.02696630133787     -2.75289164812850     17.09819571389952
  C   -0.57560166053381     -1.54683085085020     19.12704671286727
  H   -0.00893346886834     -1.06288543834571     19.91409366722386
  C   0.67591503553901     -3.39223144916990     12.33073561239166
  C   1.53631683610540     -5.55733157142575     13.28394572731614
  H   1.89239562000922     -5.99185015244792     12.36684919286068
  C   -2.47940335050025     -2.81279917316177     18.41219215507149
  H   -3.40641566148733     -3.32235032667254     18.64957615063846
  C   -1.62053505796030      0.82177241204508     12.24690447036184
  H   -1.62362125846782      1.11440006532088     11.21189807441331
  C   -1.75133810073341     -2.21618018807186     19.42953008717355
  H   -2.10490068561877     -2.26481508552396     20.45196642388037
  C   -3.88395538182176     -4.25954609976068     13.58598774659605
  H   -4.33104487136580     -4.62275601388603     12.66820719144964
  C   0.50599543202888     -2.52384736780729     10.14169289243429
  H   0.67845407356334     -2.61199008976777      9.07650732112280
  C   0.92434296098402     -3.55086173543671     10.97966877530341
  H   1.40782253322137     -4.43225345551267     10.58423072509740
  C   -2.29665423233792      0.93492553221263     15.78512786534980
  H   -1.86475240679308      1.88675740294461     16.08996690841493
  H   -1.94426425893689      0.14580478476767     16.44329645548088
  H   -3.38339372364079      0.98763349392439     15.82460935160228
  C   3.07539924216782     -1.82128819258287     14.31114039337933
  F   3.54530678454403     -3.01256716232282     14.70088846244934
  C   2.32248973622279     -1.08997814312781     15.21994209183866
  C   1.88684731909807      0.16063953878458     14.80812392324552
  C   2.14198123026736      0.65695065426823     13.54183029681924
  H   1.78555512377068      1.64180448408972     13.27164880458246
  C   3.35910586523988     -1.37189737644377     13.04012532439030
  H   3.95905824370331     -1.97752881962468     12.37471844827874
  C   2.87903096049813     -0.12237066076407     12.66565666318260
  H   3.10120203215021      0.25609131381532     11.67582943766112
  H   2.18232367985144     -1.44276910449861     16.23201889613659
  F   1.21971397924726      0.92705618958820     15.67715744507916
64
'1d_3,4
  Rh  -0.36696737727964     -2.12070279844570     14.80953058904333
  N   0.04609986345507     -2.25685406377789     12.78828009100142
  N   -1.12090256548012     -0.32992308233320     12.68827094563633
  N   1.01169476924856     -4.20468416849387     13.38664674436575
  N   -2.04578552951661      0.59483812947883     14.38297948855131
  N   1.04223078015595     -4.95698168747799     15.39016205927896
  C   -0.39940773837753     -1.30678966308926     11.98364054609736
  C   -0.86257383584718     -2.04099611838741     16.77413878670404
  C   -2.83516624087262     -3.13122498723840     15.92041397848116
  C   -2.13806573196826     -3.04604587411535     14.70739059871045
  C   -2.69650073225881     -3.56462263158499     13.54883917714696
  H   -2.17455426633875     -3.51500290123918     12.60018002077630
  C   -4.09024656190331     -3.73202555522744     15.94076639249497
  H   -4.63905018623456     -3.80391141474875     16.87264333764172
  C   -0.10279621523856     -1.52953509319339     17.82394136443305
  H   0.89790324659170     -1.14817063083108     17.65446012685006
  C   0.86039345183595     -5.10774242350371     16.82830283184382
  H   0.33437022873382     -6.03904760782789     17.03094092785009
  H   0.27256055878671     -4.26809751435670     17.18831060015073
  H   1.83151399103539     -5.11204500425086     17.32067559370275
  C   -4.64805523671468     -4.24552764337888     14.78084899554256
  H   -5.62488355093330     -4.71196352170776     14.81032696993701
  C   1.69138177282754     -5.88738757432721     14.58967809510073
  H   2.09993458075742     -6.79964156422431     14.98968419344053
  C   0.61846556365455     -3.91463075809771     14.68124210239462
  C   -0.15643588133715     -1.35458704962975     10.62386522496097
  H   -0.51031879548361     -0.58868793256758      9.94912156163302
  C   -2.37787643660750      1.35245777939538     13.26710305080277
  H   -2.99840297137610      2.22969991773954     13.33498637770816
  C   -1.27908597146584     -0.44281347665373     14.05775326248543
  C   -2.12908123089479     -2.57163897826320     17.07937813529139
  C   -0.58874424435581     -1.51853968745347     19.12760975863789
  H   0.02323917811059     -1.11474000092177     19.92586276777410
  C   0.71018386464455     -3.31222218050961     12.34708762030236
  C   1.67468671208473     -5.41969789466600     13.33100367358227
  H   2.06387901536097     -5.84283510979537     12.42190450877362
  C   -2.61386056576056     -2.55961673140888     18.38320738234613
  H   -3.59161403579172     -2.97058288430782     18.60788780801142
  C   -1.79917862253414      0.77613068620780     12.20142746583282
  H   -1.81818943393862      1.05092458757128     11.16166547655271
  C   -1.84742158856577     -2.02776874494297     19.40820880442884
  H   -2.22640669620581     -2.01950356744492     20.42263487566082
  C   -3.95076860675614     -4.16506300591284     13.58646098324180
  H   -4.37927258957009     -4.56902524015429     12.67688790182907
  C   0.56643318713739     -2.44624094200173     10.15574600520327
  H   0.78165835961618     -2.51900602739779      9.09733885536591
  C   1.01091578482833     -3.45233324515901     11.00453356696496
  H   1.56214263053187     -4.30000805196278     10.62464661383758
  C   -2.52226607605498      0.87857891734298     15.73110878720879
  H   -2.27378831508009      1.90481039348426     15.99684936085643
  H   -2.03963313921978      0.18917544668811     16.41865539973946
  H   -3.60077698354608      0.73473726096642     15.77421674032286
  C   3.54683826183746     -2.09882161901996     14.03573394000307
  H   4.15522235288056     -2.99095191345175     14.09292223857389
  C   2.82612295813326     -1.64827264925996     15.12758426548461
  C   2.04076536254903     -0.50721779994605     15.08420586876976
  C   2.02237980734592      0.22955554780744     13.90082124652983
  H   1.44872583821547      1.14728348134909     13.86106957156122
  C   3.47129558062347     -1.35021014662078     12.87945251126239
  F   4.14663280079626     -1.77123458073252     11.80551863240930
  C   2.72967964115028     -0.18287291969341     12.78746012893738
  H   2.73148733901387      0.38212166869694     11.86530267243762
  F   2.91916227573979     -2.33785567811748     16.26940406461745
  H   1.53999819582585     -0.15365147687373     15.97472833288259
64
'1d_4,5
  Rh  -0.29822701485249     -2.16561698620186     14.79686372848241
  N   0.09996942599398     -2.30989022893723     12.77406525759156
  N   -1.01350717058049     -0.35123069508008     12.68392679736241
  N   0.98923280831653     -4.29865326596296     13.35591818632933
  N   -1.93949947194018      0.57299108372280     14.37761843958197
  N   0.95520474403306     -5.08288707402580     15.34666759491262
  C   -0.30807546324591     -1.33651583938029     11.97650599383127
  C   -0.77387646679581     -2.06321812749682     16.76501927258643
  C   -2.73136071794762     -3.21479964058109     15.95659655600045
  C   -2.07462780400512     -3.08753136860124     14.72441542811188
  C   -2.66422370663822     -3.58722338021741     13.57265547851609
  H   -2.17641393443772     -3.50042690568233     12.60839929698322
  C   -3.97143763395396     -3.84456179575766     16.00486832921161
  H   -4.48849455703810     -3.94855357078452     16.95178516904468
  C   -0.02712505216006     -1.48781193914777     17.79082301391177
  H   0.93203305073141     -1.02029169020248     17.59058569677589
  C   0.73165475455333     -5.25348064602174     16.77619477552067
  H   0.03340701119949     -6.07264357039251     16.94058893134423
  H   0.30790012506874     -4.33349070935162     17.16985436351304
  H   1.67808934612657     -5.46769738274605     17.27026570988001
  C   -4.55673263317953     -4.34295104765411     14.85195644781762
  H   -5.52190424911454     -4.83135492538416     14.90234364949850
  C   1.53062006969162     -6.04973578562305     14.53165999498780
  H   1.87085725324276     -6.99498122634303     14.91848687226607
  C   0.61433896523118     -4.00093571569428     14.65360171654084
  C   -0.05652635815064     -1.37744616363000     10.61777263784029
  H   -0.37008143332180     -0.58745061478023      9.95123131852668
  C   -2.23830732582585      1.35263421529008     13.26682737705758
  H   -2.84050250999641      2.24231121959051     13.33752848683353
  C   -1.18948429365473     -0.47614718705225     14.04943845858102
  C   -2.01052246930401     -2.64398174996781     17.10155139877121
  C   -0.48223679610196     -1.48886416864810     19.10590714994098
  H   0.11966475112892     -1.03461874519064     19.88442945850889
  C   0.72304135184393     -3.38684531186568     12.32415812856467
  C   1.55386571352643     -5.56231090001406     13.28193466788132
  H   1.91727056685725     -5.99747324287114     12.36804336783544
  C   -2.46386322064699     -2.64579116815246     18.41647227021442
  H   -3.41729423191391     -3.09751106941661     18.66606007880250
  C   -1.65792183618597      0.77696612785928     12.20209282317467
  H   -1.65386103794606      1.06586496088076     11.16603496348681
  C   -1.70093045312276     -2.06956987067175     19.42042719775844
  H   -2.05639819839836     -2.07293705117823     20.44331464356912
  C   -3.90391079220545     -4.21453560642563     13.63659028170609
  H   -4.35634947719692     -4.60251461361519     12.73164732890868
  C   0.62105049000479     -2.49315839770464     10.14090965475779
  H   0.83692110991576     -2.56327319774703      9.08241811089744
  C   1.01796498648990     -3.52733978997609     10.98051248000080
  H   1.52767733495958     -4.39721519852862     10.59255748395222
  C   -2.42881182353621      0.85166464327312     15.72173423083016
  H   -2.15808000311219      1.86753563289731     16.00541813132717
  H   -1.97476556286678      0.14134131914092     16.40748288319950
  H   -3.51130630434094      0.73648058083163     15.74728177485620
  C   3.16385014987462     -1.89698695733918     14.20687129753743
  F   3.74335149505957     -3.08571030755676     14.41399117192143
  C   2.37842679768297     -1.35661787479045     15.22027381033489
  C   1.80016202467978     -0.11060574724541     15.00421096709641
  C   1.98371275803528      0.56513436771290     13.79982165561669
  H   1.54836076816793      1.53915673193769     13.62149209861982
  C   3.36304350290209     -1.26701095531886     13.00195842331746
  H   3.98121482349019     -1.70259539757138     12.22919968816567
  C   2.75131498728919     -0.03259780187180     12.82627515653517
  F   2.92345260526505      0.59191109605832     11.65648966431411
  H   2.31271890231387     -1.86526559138015     16.17213786089702
  H   1.23621733004187      0.35962621858494     15.79953471725786
64
'1e_1,2
  Rh  -0.35645791496933     -2.16069582685030     14.81691484499562
  N   0.07256129887977     -2.30323905533451     12.79853900651801
  N   -1.05987027738276     -0.35608308459514     12.68999728685612
  N   1.00625600584844     -4.26393714175988     13.40615663594537
  N   -1.97410395202862      0.59012359957207     14.37829332263571
  N   1.03151232742767     -5.00518992558014     15.41383169478668
  C   -0.35612287615427     -1.34835799824745     11.98962254507290
  C   -0.86134614935798     -2.07353637122117     16.77663103437535
  C   -2.84304027571610     -3.13712006885500     15.91449380565796
  C   -2.13669979221605     -3.06504648379540     14.70588105947411
  C   -2.69255889314524     -3.58027033754783     13.54486578562316
  H   -2.16346522683290     -3.53938254265811     12.59977043277758
  C   -4.10548216324306     -3.72229881637460     15.92765799133261
  H   -4.66159717625779     -3.78420184419659     16.85592159279559
  C   -0.09585437928771     -1.57502110780602     17.82828351559182
  H   0.91281920137177     -1.21372995800172     17.66076549748409
  C   0.85280363006917     -5.14475828500932     16.85349087074670
  H   0.33299862431601     -6.07764466949704     17.06461747587161
  H   0.26020904478504     -4.30589394171437     17.20739917013645
  H   1.82465125120689     -5.13891492295048     17.34450757294323
  C   -4.66113042784476     -4.23287704325761     14.76536220919622
  H   -5.64387513444355     -4.68701077075110     14.78929038595930
  C   1.66838434910902     -5.94758440622328     14.61789749270874
  H   2.06806570102445     -6.86167453081791     15.02264487519229
  C   0.61754583861416     -3.96248544837040     14.69954733586230
  C   -0.11839952102745     -1.40801677765355     10.62955881369638
  H   -0.44953225061317     -0.63344297893523      9.95361105232759
  C   -2.26375600709554      1.36622570946008     13.26286951071059
  H   -2.85321703884034      2.26479523255537     13.32815058950928
  C   -1.23786440162223     -0.47032498450806     14.05674795205390
  C   -2.13686990153172     -2.58423564089809     17.07657314598046
  C   -0.58686862218857     -1.55440724912211     19.12994421287794
  H   0.02868137072354     -1.16109138020368     19.93068964250127
  C   0.71115184498388     -3.37531864546190     12.36112965584396
  C   1.65422340015238     -5.48736032143939     13.35649640446584
  H   2.03532051989757     -5.92145019175048     12.44913880108879
  C   -2.62679963771995     -2.56231411452480     18.37831428855003
  H   -3.61187605202547     -2.95718220743514     18.59988689700860
  C   -1.69043563312444      0.77674542241295     12.20152368769647
  H   -1.67947259745465      1.06154656651982     11.16440114879939
  C   -1.85558339239617     -2.04138408549374     19.40550283113663
  H   -2.23852495803501     -2.02517627780424     20.41833864525181
  C   -3.95436589938903     -4.16527478503295     13.57579393810675
  H   -4.38146992124457     -4.56669450634328     12.66445168841533
  C   0.57211821335212     -2.52076195408806     10.16431179550304
  H   0.77734576331737     -2.60571527115700      9.10478816801944
  C   0.99604075248799     -3.53316890713205     11.01714547774042
  H   1.51568858830826     -4.40115096671674     10.63813634356520
  C   -2.45771929497754      0.88274862114424     15.72188770638967
  H   -2.18079604901685      1.89964103078654     15.99541524375816
  H   -2.00496477574199      0.17583558365659     16.41205122343476
  H   -3.54065243217041      0.77294303866522     15.75164338974012
  C   3.50448912864891     -1.98313562352883     13.95552838642621
  H   4.11972074386344     -2.87274120347152     13.99164446450692
  C   2.81946999329315     -1.57880992439990     15.08951778072014
  C   2.03650529248067     -0.43740021539212     15.10664583934665
  C   1.94818983907058      0.33087120576665     13.94840821402417
  H   1.36923639046719      1.24512759006545     13.92833726523602
  C   3.39970344171178     -1.22504661431301     12.80301543451594
  H   3.92567654191661     -1.50133513167438     11.89845771175336
  C   2.62019201685825     -0.08019159693155     12.81950892861154
  F   2.51504896658504      0.64943849879775     11.69669124856048
  F   2.95347372603107     -2.30013836597302     16.21216025379310
  H   1.56060921829306     -0.11505759660260     16.02284877779426
64
'1e_2,3
  Rh  -0.29168890592339     -2.13479270206934     14.78804621936654
  N   0.09878646601860     -2.28050367599360     12.76352030161237
  N   -1.04448381177259     -0.33867708079661     12.67005455893948
  N   1.00508859443221     -4.26140487553191     13.34736711095714
  N   -1.95683213363803      0.59118308026549     14.36768880806066
  N   0.98164444791423     -5.04299865863080     15.33926970418023
  C   -0.34431646995841     -1.32551658288512     11.96196351137616
  C   -0.77066624976293     -2.04418428224350     16.75727160466566
  C   -2.72340288854910     -3.19808848037573     15.93907230088892
  C   -2.06320830524602     -3.06781110065053     14.70912314716987
  C   -2.64844495023062     -3.56950838784617     13.55579923281881
  H   -2.15913680861877     -3.48211552656397     12.59240550239042
  C   -3.96202856897720     -3.83093862223100     15.98353980668270
  H   -4.48147720313169     -3.93656148972480     16.92892635059237
  C   -0.02530739574361     -1.47922354729179     17.79009096831067
  H   0.93541000590500     -1.01159351097847     17.59785184325171
  C   0.76464514123472     -5.21376719316467     16.76973996643218
  H   0.07836816701690     -6.04224790988624     16.93768848022434
  H   0.32914887370504     -4.29921780132749     17.16322261989658
  H   1.71543069647213     -5.41420911755104     17.26133083131733
  C   -4.54286560708141     -4.33046090567138     14.82896374919246
  H   -5.50698048307589     -4.82122917601291     14.87638622552208
  C   1.56377001475711     -6.00611448579110     14.52448528533680
  H   1.91429560071604     -6.94709440084251     14.91247605256615
  C   0.62995571559839     -3.96499171036111     14.64524370203262
  C   -0.13245573021300     -1.38803067520180     10.59685325919868
  H   -0.48468115322804     -0.61833370802090      9.92571209199240
  C   -2.28235135942380      1.35507744944339     13.25374353104111
  H   -2.88839629759734      2.24184762269576     13.32603211886944
  C   -1.20083671693953     -0.45200165529079     14.03942976063474
  C   -2.00673211929597     -2.62972245882390     17.08771549497547
  C   -0.48219390462235     -1.49174202121400     19.10445994185333
  H   0.11895459322022     -1.04462875095142     19.88765422807797
  C   0.71862516524002     -3.35915396186324     12.31314039644962
  C   1.57984168388159     -5.52072390195131     13.27405667238472
  H   1.94596964341201     -5.95372646420957     12.36026517776012
  C   -2.46214410338709     -2.64265855593967     18.40184454731555
  H   -3.41524482653615     -3.09788660608721     18.64613715824404
  C   -1.71267881409719      0.77541062713281     12.18652032003007
  H   -1.72365661231550      1.05683214283732     11.14863584785422
  C   -1.70153305519627     -2.07447468211321     19.41200124355127
  H   -2.05883538862721     -2.08653602880953     20.43417188581567
  C   -3.88650892114271     -4.20030743346305     13.61579640680522
  H   -4.33488367403662     -4.58946864071592     12.70934026066290
  C   0.54718961551802     -2.50243487228101     10.11956939568311
  H   0.73048011827172     -2.59012002121950      9.05615951418600
  C   0.98115344702913     -3.51697660891516     10.96445781870209
  H   1.48738494204114     -4.38883196227211     10.57648302526610
  C   -2.41582909619739      0.88829470274496     15.71802616116046
  H   -2.11322073667172      1.89786764122775     15.99181145575170
  H   -1.96890291728972      0.16941969425825     16.39947037016463
  H   -3.50033518512890      0.80138924059998     15.76216560724204
  C   3.23108807449187     -1.95799023415970     14.25848957697296
  F   3.83541774532545     -3.13537376341566     14.48196814670678
  C   2.42628046711397     -1.42881174919829     15.26069204280852
  C   1.79114042023834     -0.21353067112329     15.03466376695351
  C   1.98493379550792      0.42437095044090     13.81492377729833
  F   1.36037906004942      1.59324856177569     13.60120909123446
  C   3.42149805497964     -1.32113413416625     13.05573965921578
  H   4.06985660330850     -1.76144424076612     12.30970095333328
  C   2.78374528740917     -0.10269878317698     12.82872454495547
  H   2.91886404699680      0.43577002069127     11.89995086599934
  H   2.36132902966301     -1.93078573176471     16.21664575755787
  H   1.21151487618784      0.27282780742251     15.80781024150668
52
'Rh(CNC)(biph)
  Rh  -0.35052827667659     -2.16417637404082     14.79050448959132
  N   0.10893188090188     -2.27329060854324     12.76934602872539
  N   -1.02362202224071     -0.32304457480078     12.68127299590869
  N   1.02207510773952     -4.25161238546858     13.35805842313759
  N   -1.96873291798761      0.58937696954083     14.37176601524137
  N   0.96890268940797     -5.05097176282373     15.34345460519401
  C   -0.31781324555711     -1.30839190146789     11.97082185019577
  C   -0.80856107014416     -2.06724612829621     16.74243674573393
  C   -2.76489584666910     -3.21659753725381     15.96606127841731
  C   -2.11594086284238     -3.09149215837384     14.72842201286764
  C   -2.69819955854556     -3.59136898851217     13.57574945162041
  H   -2.20867616025840     -3.50185951435685     12.61263365019968
  C   -4.00213673974871     -3.85097350527948     16.01406096739021
  H   -4.51654451281993     -3.95601553265797     16.96241553062709
  C   -0.02071116643539     -1.48835549873673     17.73155881699348
  H   0.93451723676513     -1.03352014833928     17.48205264441361
  C   0.71740561337066     -5.24015246760183     16.76709262479813
  H   0.01535358702110     -6.06081229142524     16.90573232994722
  H   0.28915329545067     -4.32452724248061     17.16551347997334
  H   1.65415207161611     -5.46220305637279     17.27551759834698
  C   -4.58603728694456     -4.35182875978401     14.86075179472531
  H   -5.54938870068568     -4.84356549466807     14.91232896944855
  C   1.57574370924978     -6.00014023639561     14.53257478100357
  H   1.92822547569451     -6.94136728479816     14.91857716153146
  C   0.61705508658324     -3.97078121701682     14.65162847961242
  C   -0.08296035077760     -1.35810899227317     10.60942806529161
  H   -0.41945367597591     -0.58118134615020      9.93850274027797
  C   -2.26582748219925      1.36887634740315     13.26237560809893
  H   -2.86948179786229      2.25761358991531     13.33260758300071
  C   -1.21192711440932     -0.45497219539664     14.04619860780171
  C   -2.03583679322204     -2.64317048125712     17.10444049788873
  C   -0.44282916775325     -1.48172472199894     19.05748632188133
  H   0.17959922007361     -1.02807444529916     19.81997903300078
  C   0.74300404758336     -3.34488239395615     12.32171952569682
  C   1.61064611547559     -5.50361962591563     13.28562205171944
  H   1.99861334513531     -5.92613201686676     12.37568765818819
  C   -2.45525173044868     -2.63525911756202     18.43050992616193
  H   -3.40311167164318     -3.08079454136153     18.71121376021991
  C   -1.67574458575811      0.80004183924960     12.19896112331678
  H   -1.66451743270286      1.09557195654502     11.16478481786311
  C   -1.65826885896437     -2.05467193903140     19.40610148802818
  H   -1.98463901641667     -2.04873999309477     20.43866743502898
  C   -3.93624702256152     -4.22295139338316     13.64388566072867
  H   -4.38875806013515     -4.61352243056389     12.74022330161554
  C   0.60528549078561     -2.46865389877880     10.13426697076369
  H   0.80893995713353     -2.54513530773372      9.07372506644112
  C   1.02840734493340     -3.49029086032279     10.97684495600198
  H   1.54696167867923     -4.35472296478055     10.58848031802957
  C   -2.46357409235170      0.86630767549440     15.71492564701398
  H   -2.17178434056890      1.87297441608515     16.00954050282877
  H   -2.02965738237721      0.14139528727183     16.39805663832882
  H   -3.54848400991631      0.77461525371562     15.72823196913827
12
'benzene
  C   3.11127893178842     -2.15225171018214     14.36888333105462
  H   3.57421876497724     -3.10881788178798     14.58048168236205
  C   2.29301394443815     -1.55248561611200     15.31529256672643
  C   1.70027715289632     -0.32768258763245     15.04384804285460
  C   1.92635287872599      0.29771476427959     13.82619076965347
  H   1.46369976071118      1.25437558075562     13.61436249948643
  C   3.33733220151606     -1.52685154743841     13.15113947399903
  H   3.97644015775830     -1.99514452884363     12.41200427455095
  C   2.74462099716911     -0.30207717806002     12.87971337557683
  H   2.92100568648611      0.18611012642452     11.92857844306166
  H   2.11649467230320     -2.04066512316087     16.26639651934406
  H   1.06105485122993      0.14028570175776     15.78314902132979
12
'fluorobenzene
  C   3.26221168884711     -1.97117797801729     14.22804061256232
  H   3.74060632298138     -2.92068793814235     14.42991272119170
  C   2.46142937753611     -1.39036049026274     15.19118621227085
  C   1.82467673773272     -0.18138189762963     14.99348235779109
  C   2.00150372517250      0.46684072906637     13.78013710107347
  H   1.50979942844640      1.41645558187649     13.60750156432660
  C   3.42772248010563     -1.30899373200786     13.02070037171800
  H   4.05253272747249     -1.74954600841542     12.25333256742546
  C   2.80027052907074     -0.09263091228927     12.79331392045532
  H   2.93381477046626      0.41879403402779     11.84841091367749
  F   2.29546389269705     -2.02593720468139     16.36551448096637
  H   1.20706831947159      0.23352581647530     15.77933717654133
12
'1,2-difluorobenzene
  C   3.27296856882600     -1.97734434963304     14.21321936291984
  H   3.75072418499727     -2.92700463272007     14.41706975027609
  C   2.47636082082507     -1.41166022325574     15.18632727144050
  C   1.84874868036927     -0.19633183783460     14.96138392019503
  C   2.01244476306640      0.46300956754230     13.76147522326190
  H   1.51048063174871      1.41055404996636     13.61387156571207
  C   3.44073502758664     -1.31748635638400     13.00402625660192
  H   4.06528192692749     -1.75817870803836     12.23764214205149
  C   2.81288834929087     -0.10262478233538     12.77893744949674
  H   2.94348118436868      0.41200890700059     11.83570702281278
  F   2.30074805536489     -2.03048230596771     16.35878081516123
  F   1.08222780662871      0.33044067165966     15.92241922007040
12
'1,3-difluorobenzene
  C   3.27259134777306     -1.99178854547433     14.23219216135928
  H   3.75081166103074     -2.94082851793928     14.43250467738292
  C   2.47155698335957     -1.41002550590382     15.19521772692183
  C   1.83213234949802     -0.20092786832318     15.00368760630323
  C   2.02374943418969      0.42439156032631     13.78736150392335
  F   1.41332023792701      1.60023347558043     13.57405320507939
  C   3.43612833268147     -1.32688535619041     13.02634946020314
  H   4.05992500330199     -1.76465169533789     12.25719817433812
  C   2.81369479469350     -0.11068383271932     12.78870462214173
  H   2.93080453806963      0.42009932438077     11.85381745213082
  F   2.30268457800628     -2.04009144042909     16.36795812157548
  H   1.20969073946903      0.23605840202981     15.77181528864071
12
'1,4-difluorobenzene
  C   3.25883403051013     -1.98021254282551     14.24690010042885
  H   3.73843898433886     -2.92949489590824     14.44564111462108
  C   2.45856569506727     -1.40145386173412     15.21175968486212
  C   1.82289858373528     -0.19226103012482     15.01151856862494
  C   1.99398422466180      0.46274895543319     13.80158390681690
  H   1.51439397816296      1.41203275497050     13.60286992575176
  C   3.42998920597148     -1.32528881765951     13.03693136987105
  H   4.04828901844459     -1.74274072163645     12.25331681820311
  C   2.79427386920448     -0.11606808019790     12.83671184545121
  F   2.96015395841284      0.51936922389109     11.66258455860995
  F   2.29265403805993     -2.03692800186833     16.38588647485464
  H   1.20461441343038      0.22519701766009     15.79515563190435