126
Coordinates from ORCA-job /scratch/magstr/orcajob__5658506-Qzcs/orca
  N   -2.23941003252878     -3.96241237616181      2.53389135888531
  C   -2.16655808060596     -5.14788916291272      1.67650923534890
  C   -2.77987626939929     -6.32781103041474      2.41354700632788
  N   -4.03978521967075     -5.90035454584548      3.08665916507875
  C   -5.15920783010121     -5.69900919797783      2.12364495481709
  C   -6.18656417560682     -4.75185172500275      2.72259737110332
  N   -5.48901100582379     -3.63930310921144      3.37224073593031
  Mo  -3.62431165637880     -3.95563012709130      3.95272736203209
  N   -3.28301714878287     -5.09748180477920      5.52565465392187
  C   -3.50174673279075     -6.53795521062752      5.40406962905357
  C   -4.41324785298542     -6.79944181834172      4.21380886294067
  H   -3.99916802051579     -6.94002110828337      6.30237577105127
  H   -2.54535593233459     -7.08520248815131      5.30127007504813
  H   -5.44705666764211     -6.55363531061714      4.49043869550662
  H   -4.38117088476049     -7.85342842451632      3.89095252230029
  H   -6.84221768115524     -4.39645412569581      1.91051299507848
  H   -6.84197443552202     -5.28891958782893      3.43411428909124
  H   -4.72662501503003     -5.24654118969542      1.22177786309287
  H   -5.60554869169551     -6.66851384840234      1.84658403490044
  H   -1.12298501117582     -5.40439531299727      1.42745963576097
  H   -2.68221852921770     -4.97767045554913      0.71149203560980
  H   -2.09587696547666     -6.66259394670293      3.20488038845804
  H   -2.97372959285244     -7.17869004253102      1.73956578267025
  C   -0.38960187408879     -2.88550477376701      1.22247371300701
  C   -1.73297227203815     -2.71007008485125      1.93333420679584
  C   -2.80698920169415     -2.06961315767273      1.03577780743522
  C   -2.51513669154024     -0.62381403232207      0.60377753397524
  C   -3.76138751689037      0.02369736401655      0.05868454718624
  C   -4.65743924782106      0.67959436726235      0.91437934363197
  C   -5.86260324377204      1.19454082551183      0.44280665994922
  C   -6.22011591818833      1.07217998218737     -0.91114631264817
  C   -7.50628794242247      1.60414758308266     -1.41196275069180
  C   -7.60559396683950      2.17024370091097     -2.69507091453042
  C   -8.82015232954421      2.66900867326748     -3.16497488857652
  C   -9.96279008589467      2.61140389348763     -2.36316587808624
  C   -9.87940626919348      2.05096001554223     -1.08616595609952
  C   -8.66441751883447      1.55374414629391     -0.61592795260788
  C   -5.31385513592881      0.42746773950370     -1.77099787053268
  C   -4.10920382861228     -0.08619428597003     -1.29412973429588
  C   -7.15032311657382     -1.89886658379359      2.68623529925609
  C   -6.35206277871833     -2.53231678271513      3.83042700846110
  C   -7.26732239003913     -2.95322998984913      4.99647827529591
  C   -6.48826697124962     -3.36476112695790      6.25355126432262
  C   -7.19763704086827     -4.33389884351113      7.16461048628173
  C   -7.66667003543837     -5.56222119099874      6.67390631675173
  C   -8.30457650033457     -6.47843791672720      7.50432613194672
  C   -8.49476583517249     -6.21017099870982      8.87183937560605
  C   -9.18867748451325     -7.17638637910045      9.74995744212276
  C   -9.09382161102305     -8.56093122860902      9.52190266633569
  C   -9.74907540286114     -9.47106031888651     10.35046934519762
  C   -10.51508697606717     -9.01649146082883     11.42664320853829
  C   -10.61852560704298     -7.64495335370341     11.66576374865535
  C   -9.96286145190233     -6.73620720773282     10.83738676638131
  C   -8.00613392292048     -4.98999828399018      9.36732578036310
  C   -7.37464512268469     -4.07166312497318      8.52904217926157
  C   -1.17917959600556     -5.06968355527897      6.86511523587840
  C   -2.64691308134500     -4.63687441496239      6.77354990110347
  C   -3.48600997915314     -4.97737372996457      8.03472965424649
  C   -3.09202987310887     -6.22500643223391      8.84497743806760
  C   -4.07658265964643     -6.46787396625695      9.96165107784751
  C   -4.16898550930941     -5.58077372328289     11.04455951927082
  C   -5.11987068722779     -5.76280412194752     12.04476630367232
  C   -6.01455953552523     -6.84715713851689     12.00650068684944
  C   -7.04164438511303     -7.02728064009005     13.05485554293326
  C   -7.42326157995489     -8.30980599430409     13.48338152303443
  C   -8.39655978493814     -8.47573780141590     14.46725650510499
  C   -9.01185607020901     -7.36262689903284     15.04457725615090
  C   -8.64372774616436     -6.08074697544683     14.62829764153786
  C   -7.66924162813748     -5.91575887259780     13.64494150878151
  C   -5.90501654941010     -7.74706763247889     10.93475569416459
  C   -4.95832193930693     -7.55483922743694      9.92997108420765
  H   0.33803435804753     -3.38893777060535      1.87462748673940
  H   0.02162260340985     -1.90388774664528      0.95081387035971
  H   -0.49379325341439     -3.46982504031313      0.29704636848717
  H   -1.55607701457793     -2.01315558106302      2.77182878943733
  H   -3.75842761821030     -2.08054428791516      1.59516083583260
  H   -2.97251858603205     -2.69425831934222      0.14220952663946
  H   -1.71176579990420     -0.60253623884521     -0.14766549371092
  H   -2.15490371600955     -0.05241594746225      1.47680710050459
  H   -4.39942835481021      0.80127746030895      1.97062676643344
  H   -6.52821231585960      1.72363293200367      1.12724364513066
  H   -6.71428662656990      2.24402069604162     -3.32095192057577
  H   -8.87274252406876      3.11347781283067     -4.16036597138871
  H   -10.91281868778804      3.00173464099692     -2.73126228971925
  H   -10.76815628623415      1.99400789095621     -0.45512702915351
  H   -8.61613991523408      1.09631232564269      0.37437234238047
  H   -5.56884803636544      0.30766881484565     -2.82547127796090
  H   -3.42885058085641     -0.59142431826357     -1.98441191445463
  H   -7.95534985312528     -2.55961724892875      2.33392478806576
  H   -6.49828760427008     -1.65492539185551      1.83587592119609
  H   -7.62042883054691     -0.96817154694981      3.03394617082262
  H   -5.66997600444287     -1.75312905122978      4.21282290439109
  H   -7.91144541364020     -3.78083439299362      4.66218907186395
  H   -7.94894892965846     -2.12077898583071      5.23113023637608
  H   -6.19785523392503     -2.46895374437085      6.82580121947974
  H   -5.54636966067078     -3.84661392914736      5.92592746278534
  H   -7.54767497412642     -5.80229979953348      5.61404301090797
  H   -8.68655651513344     -7.40912641670993      7.08118802814716
  H   -8.47624375997098     -8.92992733881695      8.70083552000700
  H   -9.65327981163267    -10.54171743877472     10.16060499164301
  H   -11.02310973096688     -9.72787047175346     12.07947658218497
  H   -11.20901812317469     -7.27945044493440     12.50694581845948
  H   -10.06630503082162     -5.66655239133718     11.02579333071626
  H   -8.10059238836857     -4.76721164660041     10.43115414982479
  H   -7.00090850113040     -3.13352287711148      8.94718529316601
  H   -0.62828360470730     -4.72400464385837      5.97860137392482
  H   -0.70353232252204     -4.64075200393915      7.75897958700117
  H   -1.07652171777598     -6.16154847378065      6.92728790879973
  H   -2.64918872214839     -3.53695099466896      6.70486685671838
  H   -3.43939206978150     -4.11365377912067      8.71678790850130
  H   -4.54252170437971     -5.06029316272866      7.73704369552800
  H   -2.08128715391144     -6.08842437265519      9.26161372294039
  H   -3.04772932796539     -7.11756400064857      8.20353480612446
  H   -3.47774855237114     -4.73648568075803     11.11242915954050
  H   -5.15385240484353     -5.06810266868943     12.88614419747999
  H   -6.93724793769279     -9.18630587923539     13.05153202457473
  H   -8.67381377872014     -9.48140056064224     14.78826544149493
  H   -9.77373826728005     -7.49296498784955     15.81481601241451
  H   -9.12373617931971     -5.20415677309363     15.06735500893293
  H   -7.40506928037420     -4.91068222760687     13.31007509503407
  H   -6.59748296148080     -8.58693552458210     10.86688706595622
  H   -4.90911261879496     -8.26138944795567      9.09707348602180
  N   -3.17456069597393     -1.88057032168120      4.80368604376356
  H   -3.71580145190866     -1.67628712297378      5.65066924264182
  H   -3.39327543944174     -1.13327338322274      4.13565651558657
  H   -2.18750076120043     -1.76143528741191      5.05504466645060
