110
Coordinates from ORCA-job /scratch/magstr/orcajob__5658561-nGfg/orca
  N   -3.54335674814822     -3.32764046743893      2.51179091867306
  C   -3.80518687632512     -3.92699285534594      1.19899253690686
  C   -3.26647337127268     -5.34905736052049      1.17229110083477
  N   -3.80929708675480     -6.07898583478023      2.33828711614351
  C   -5.10291274924597     -6.71428422797561      2.02942904702519
  C   -5.90316584156905     -6.87455494637610      3.30328085098631
  N   -6.01816963676902     -5.59514615950511      4.02128161646193
  Mo  -4.28080148296139     -4.52461963456024      4.00703980742151
  N   -2.79597754105966     -5.55629599659305      4.83611920966523
  C   -1.93431253523109     -6.23675015763187      3.85891522093370
  C   -2.81718795378066     -7.02019548966654      2.90321411515990
  H   -1.22536403078377     -6.92738278966816      4.33724615476584
  H   -1.32531270615718     -5.50649022435783      3.29226962403045
  H   -3.35523913325384     -7.79390158382014      3.46810994386145
  H   -2.24102834873218     -7.50977912467552      2.09661848466839
  H   -6.88759880451277     -7.27482036368421      3.01271984414614
  H   -5.43973207217053     -7.65311981445509      3.94233048915427
  H   -5.64625551540187     -6.04000865540975      1.35180455163054
  H   -4.95399584090867     -7.68138998147137      1.51147192678771
  H   -3.33391849468535     -3.36063238407236      0.37968197382590
  H   -4.88585535258389     -3.93392808896775      0.96625292454279
  H   -2.17339738467979     -5.31697552253731      1.27120855747007
  H   -3.51295318707029     -5.88382253564142      0.23599536220295
  C   1.28721325615062      0.47252253797789      1.67877607600446
  C   0.13966275248343     -0.41554967047692      2.16535141705459
  C   -0.19777660419963     -1.63695615915984      1.28178754286381
  C   -0.61441690365947     -1.18755667341807     -0.13044932069842
  C   1.05211738617265     -2.52816392945489      1.14007889130129
  C   -1.27960790586574     -2.56376665012181      1.91673749988052
  C   -2.68677531059209     -2.10565159602275      2.43571847166510
  C   -2.51976444316141     -1.50143322454037      3.83100445175180
  C   -3.37926966691607     -1.03963947634805      1.56357369657476
  C   -7.53562077143030     -2.13354823335459      1.31915022446776
  C   -7.42375542462056     -3.40039846468759      2.16776377551348
  C   -8.73849388796720     -3.95319597824549      2.75635969451804
  C   -9.44857685893788     -2.88608898421302      3.61027077874373
  C   -9.69721214624785     -4.33829461208532      1.61246779068654
  C   -8.49344966560221     -5.26914104508911      3.55144830855297
  C   -7.37904202221057     -5.44128066512318      4.63059245388258
  C   -7.72470056653577     -6.72177450065983      5.43398650666355
  C   -7.42126909219390     -4.30360159323804      5.64527270639078
  C   -0.41551362960542     -2.69449363825650      9.63289316808622
  C   -1.05344480113131     -3.24099418199474      8.35460043891725
  C   -0.29599450234295     -4.39054481185544      7.64284048298058
  C   -0.07428521794815     -5.57233465539396      8.59725199218787
  C   1.08392627624590     -3.87648434997376      7.18747255518119
  C   -1.04051767953708     -4.78752123807691      6.33530298043430
  C   -2.33486827814335     -5.65447376738653      6.25517285168000
  C   -3.45511602564539     -5.17357135440720      7.17852256305393
  C   -2.08152704594297     -7.13732741971476      6.61318840467192
  H   1.09157416964024      0.88125156908686      0.67688376939240
  H   1.42227742216701      1.32540133340396      2.35971966515405
  H   2.24279877538221     -0.06904443643355      1.63901649426888
  H   0.37517464383772     -0.77916759509829      3.18023175401890
  H   -0.76138216411014      0.21012134171061      2.26212469298578
  H   -0.96936906201791     -2.04843914774063     -0.71796938145944
  H   -1.41656236187776     -0.43914216198465     -0.10998888818529
  H   0.23750840157841     -0.75049508605755     -0.67100790372251
  H   1.43246222693491     -2.83525254576546      2.12678787741117
  H   1.86117814459440     -2.00991270434054      0.60626823428753
  H   0.81174015037691     -3.44049576219012      0.57239543153654
  H   -1.43750157590484     -3.34281664032456      1.15689335155972
  H   -0.81618844089281     -3.08111738448805      2.77509621715214
  H   -1.74677374274130     -0.72634725286172      3.82649253493392
  H   -2.22438792641445     -2.27453110442290      4.55425342626767
  H   -3.45599991014434     -1.03124367731985      4.15899938678694
  H   -4.38225003563546     -0.85246559117278      1.97378953042639
  H   -2.82285968755220     -0.09134980409886      1.57881776589225
  H   -3.49053476810136     -1.34200546956599      0.51459162726732
  H   -6.54202997991383     -1.84137975972440      0.94847496812883
  H   -8.18797287774055     -2.27015580133873      0.44430600733078
  H   -7.92738523198624     -1.28656010897851      1.90087282359379
  H   -6.71419112304559     -3.20992816216540      2.98740165130295
  H   -6.96851029153117     -4.20089040205934      1.56091034558333
  H   -9.84121975029051     -2.08021454180771      2.97316536452890
  H   -10.30264118582997     -3.32788746865553      4.14650071171946
  H   -8.78326734001069     -2.42732622102026      4.35172716340132
  H   -10.60866168697432     -4.80877447495940      2.01310937497330
  H   -9.22082818864342     -5.05490762031716      0.92521590693155
  H   -10.00633644479208     -3.45858516292164      1.03015468300990
  H   -8.34468787554014     -6.06695225510981      2.80381290307331
  H   -9.45163334835155     -5.51676065514131      4.04192391202752
  H   -6.90990216919132     -6.94804563835826      6.13801114101950
  H   -7.88351978240080     -7.60051011260465      4.79466256389676
  H   -8.64659643113467     -6.56096862286802      6.01138420927302
  H   -8.44170829197734     -4.20522605117365      6.04065632194410
  H   -6.75304057169818     -4.53070778700241      6.48991620320118
  H   -7.11672368742711     -3.34916494284648      5.20790898851800
  H   -0.32870547991107     -3.46859168901153     10.40923309032189
  H   0.58839986045145     -2.28272988885236      9.45640481357646
  H   -1.03239119805656     -1.88411900427022     10.04794907011699
  H   -1.17019957662001     -2.41819126670827      7.62780542048566
  H   -2.07098467538344     -3.57900447061531      8.59204579941182
  H   0.35884925608475     -6.43143339872271      8.06446173622082
  H   -1.01086222747337     -5.90069753770054      9.06998203345231
  H   0.62338701505556     -5.29520856566526      9.40089486881281
  H   1.65268447472629     -4.68070995137401      6.69642229857817
  H   1.68312517451866     -3.51504791005762      8.03528798004782
  H   0.97739217946955     -3.04977512937808      6.46745823286316
  H   -0.30292266839063     -5.29501019205622      5.69005665745841
  H   -1.28718110617270     -3.84461301402988      5.81914506462944
  H   -3.19788568311771     -5.37413028542144      8.22735191736767
  H   -3.65331521420320     -4.10490894932579      7.05155748918193
  H   -4.38129091652053     -5.72098794028878      6.94209932040999
  H   -2.93488856468655     -7.74466128587266      6.27667531671170
  H   -1.16405699508355     -7.54496378704947      6.16760476714434
  H   -1.99023370131591     -7.25807705556325      7.69912243821071
  N   -4.76725808450295     -3.00386736832469      5.26012983989328
  H   -4.19809018979301     -2.16949091201644      5.37854025638811
  H   -5.31962620627074     -3.13323495450123      6.10551097897383
