123
Coordinates from ORCA-job /scratch/magstr/orcajob__5658498-E3PJ/orca
  N   -2.19507093152541     -3.63531801271406      2.40420541224267
  C   -2.21691167836570     -4.65791867913184      1.35890489950256
  C   -2.23278924860562     -6.06027628139983      1.95747348690114
  N   -3.24780784024965     -6.15628622185992      3.01165196700204
  C   -4.62881693329777     -6.20431947035551      2.52120257952583
  C   -5.57911716422786     -5.55339862511068      3.52279080949496
  N   -5.06208072352583     -4.26930237871763      3.99637556378351
  Mo  -3.10123240357611     -3.97144273057888      4.14961929742715
  N   -2.13669381490919     -5.18991313326133      5.39537823334920
  C   -1.84401146210658     -6.56599321967518      4.98829203758435
  C   -2.93617067914055     -7.11606857398844      4.07602099716517
  H   -1.76761690612804     -7.23592604491755      5.85888722427192
  H   -0.86108121500831     -6.62329275413493      4.48030221475000
  H   -3.85112033743262     -7.25465923458601      4.67072916465883
  H   -2.64337930586080     -8.10455453308193      3.66883160137092
  H   -6.55584492434035     -5.42568552595676      3.02582831559816
  H   -5.75761270557485     -6.24117004021921      4.37366315822550
  H   -4.66408955198759     -5.63263194541417      1.58304875201607
  H   -4.95060931486746     -7.24080487750394      2.29681458870815
  H   -1.32573040562220     -4.57971090498489      0.71320504654275
  H   -3.09120348259014     -4.52292547744878      0.69129164327945
  H   -1.25545749698676     -6.25869656405202      2.42018924235554
  H   -2.38812991632216     -6.81766156423912      1.16363971338410
  C   -0.47578639318960     -2.21302075024139      1.24859337591822
  C   -1.84586737475584     -2.28061337243259      1.93197273592507
  C   -2.97075982542446     -1.69964742589464      1.05724601386526
  C   -2.87165436863508     -0.18063089952089      0.84501101969873
  C   -4.11953877889453      0.36550983303502      0.20345899519213
  C   -5.27001218113904      0.60213456313309      0.97112985838323
  C   -6.44999707590045      1.04923559701384      0.38285716495873
  C   -6.52766675632504      1.27976489496174     -1.00244486364131
  C   -7.78126983572723      1.75354996934015     -1.62891949754682
  C   -7.75603211517090      2.64216836809469     -2.71875449880016
  C   -8.93825172864490      3.08751670434969     -3.30945456890294
  C   -10.17487033373346      2.65477302798803     -2.82399640130869
  C   -10.21632187858365      1.77221472800607     -1.74159943977136
  C   -9.03369494847500      1.32699460195560     -1.15166514049972
  C   -5.37370356795373      1.04662801771721     -1.76954234033671
  C   -4.19478765189580      0.59719575486022     -1.17611106974606
  C   -6.82012955986814     -2.70049717755006      3.19669420760653
  C   -6.09975974783267     -3.30354024559778      4.40883725699701
  C   -7.10490086991181     -3.89492239427293      5.40877382652720
  C   -6.45527666415585     -4.45183626048713      6.68185331415494
  C   -7.45672569984933     -5.05912158276760      7.62831686474729
  C   -8.17604133535860     -6.20929397337763      7.26894279848824
  C   -9.10618786686153     -6.77959393822225      8.13249054730529
  C   -9.35361037635193     -6.22718515747148      9.40275936625936
  C   -10.31683173137155     -6.85368727253450     10.33359029908001
  C   -10.52380032040285     -8.24520663056165     10.33149884069151
  C   -11.42773744780181     -8.83999630250175     11.21004029777548
  C   -12.14562263784907     -8.05780512054338     12.11813622774221
  C   -11.94834178806996     -6.67514852350178     12.13583851086323
  C   -11.04729681621362     -6.08116215598262     11.25354616202929
  C   -8.63558321650409     -5.07438659840278      9.76026099261229
  C   -7.71072379810491     -4.50265610579650      8.88766964742252
  C   -0.18828720000954     -5.30082151451232      6.98960222958201
  C   -1.59166272963684     -4.75804556931447      6.70135150545382
  C   -2.58539546210187     -5.00185673996103      7.85468534666090
  C   -2.91550685992609     -6.46251968142286      8.18903806003868
  C   -3.91795678204258     -6.59870566876958      9.30934254331695
  C   -3.70160535137985     -6.00653828184027     10.56310708286795
  C   -4.65301625302739     -6.09561731645232     11.57616447043839
  C   -5.85903517110308     -6.79158535548354     11.38084486261748
  C   -6.89914022721694     -6.83417260473351     12.43041763881214
  C   -7.70051245658654     -7.97372004490500     12.61552441730609
  C   -8.70010252223332     -7.99838414797970     13.58652731693217
  C   -8.92350315978929     -6.88249186422355     14.39546904394182
  C   -8.13550445641768     -5.74153490876701     14.22475957153175
  C   -7.13516250359208     -5.71804599983216     13.25321605869832
  C   -6.06093605836165     -7.41068053419823     10.13766714801439
  C   -5.11170315020775     -7.30717068931221      9.12342757149776
  H   0.28629248949961     -2.71137245763452      1.86473359253995
  H   -0.17218134656530     -1.16470533395095      1.11943085086781
  H   -0.48089273674917     -2.67798844809914      0.25137438197105
  H   -1.79714928054976     -1.66529652539878      2.84238956700014
  H   -3.92681669390402     -1.92145071695373      1.55774079862434
  H   -2.99964969013533     -2.20261237327437      0.07584857001520
  H   -1.99647979838701      0.06256080345295      0.22338320723669
  H   -2.71801205008282      0.30017978988586      1.82570021212325
  H   -5.23397089745514      0.44095474927123      2.05173645727230
  H   -7.32021781638781      1.25123795223401      1.01033197805546
  H   -6.79644113429205      3.00667474317682     -3.08991659626302
  H   -8.89374327858450      3.78422737027712     -4.14870611912416
  H   -11.10009393517364      3.00322631406645     -3.28590760468993
  H   -11.17647240970530      1.42095890423669     -1.35892793317612
  H   -9.07716549744717      0.61850050219922     -0.32238032948278
  H   -5.40808895804795      1.19747189783133     -2.85024935569226
  H   -3.31412554972161      0.41557674828069     -1.79769508346872
  H   -7.35887277341351     -3.46546880535126      2.61662589399088
  H   -6.10090217440979     -2.20582146314393      2.52941985166961
  H   -7.55871416521595     -1.95329519163050      3.52336523311529
  H   -5.55636549089820     -2.49295204361586      4.91638348507315
  H   -7.70121845901718     -4.68316169150171      4.91959136921557
  H   -7.82024836013334     -3.10301120499280      5.68371903414086
  H   -5.90075223885235     -3.64835937897248      7.19115980042359
  H   -5.70420036509330     -5.20987695167121      6.40210555508034
  H   -8.00501130013018     -6.66668732731504      6.29070926540559
  H   -9.66290952338962     -7.66235430321905      7.81226642058754
  H   -9.94640675218688     -8.87222145184028      9.64980095013093
  H   -11.56365702195864     -9.92318335707256     11.19394105503072
  H   -12.85160184230154     -8.52270225340057     12.80841635230809
  H   -12.50448310306796     -6.05221392069480     12.83888797104573
  H   -10.91908024379592     -4.99751836518724     11.26428396199873
  H   -8.76956815479882     -4.64548219040235     10.75460519142880
  H   -7.15040105590251     -3.61891283316931      9.20254423045617
  H   0.49828050200518     -5.05242777971596      6.16754471034934
  H   0.20054210278755     -4.83800917038364      7.90807761081293
  H   -0.16687371860497     -6.38993154429884      7.13429978060651
  H   -1.50409187830449     -3.66470980586128      6.62730389574264
  H   -2.18179454549684     -4.50440841225690      8.75242643657627
  H   -3.51949078416749     -4.47725507878853      7.60018690953229
  H   -1.98896588807557     -6.99949108609389      8.45722831837908
  H   -3.32727479389795     -6.96236321618754      7.29929622718805
  H   -2.77257872131286     -5.46327603030432     10.75141376516842
  H   -4.45307733638727     -5.62999658924074     12.54334230103519
  H   -7.52939355128029     -8.85474239224842     11.99450000302074
  H   -9.31557359112228     -8.89129844245571     13.70520179997477
  H   -9.71332060651712     -6.89852857519383     15.14826035809556
  H   -8.30916503787871     -4.85873044026812     14.84318952232958
  H   -6.54420071957666     -4.81187959309170     13.10673743958821
  H   -7.00192718624629     -7.92580474594476      9.94072702709000
  H   -5.31536611333018     -7.76365580532171      8.15142740669510
  N   -3.02016904749628     -2.47749493651616      4.90747495236179
