92
Coordinates from ORCA-job /scratch/magstr/orcajob__5661745-Rma2/orca
  N   -2.34868245400376     -3.54925460055000      2.83032225552461
  C   -2.01998458049309     -4.40793827495505      1.68724098076019
  C   -1.90834726105948     -5.84892537460001      2.16192694332644
  N   -3.07864062636517     -6.18381135020970      3.00984985638602
  C   -4.29177579435209     -6.47478842180633      2.21082089467057
  C   -5.54495005640756     -6.20770126564362      3.03255518733602
  N   -5.41268989350584     -4.91978265795329      3.71362476257245
  Mo  -3.56669212949944     -4.32114272892409      4.19662707794050
  N   -2.62357763569808     -5.35955672139636      5.59596268991795
  C   -1.99784235632097     -6.61926801138474      5.17699692884793
  C   -2.78392873425786     -7.22538793593463      4.02260084711540
  H   -1.97003398256844     -7.35718291791076      5.99477647557162
  H   -0.94309579123037     -6.45924712947317      4.87522251307717
  H   -3.74922650060076     -7.59179521606140      4.40063966972744
  H   -2.24457922163815     -8.07675046713801      3.56836615043078
  H   -6.39950026923600     -6.21499139229522      2.33528585851375
  H   -5.72369803227114     -7.04086510644326      3.74172123738051
  H   -4.28177963641841     -5.79288355382774      1.34847353989018
  H   -4.27220637423336     -7.51306049098009      1.83115770147640
  H   -1.06529042371581     -4.12441898596504      1.21873589194787
  H   -2.78824399751989     -4.32321635705202      0.89452971934982
  H   -1.00981283688912     -5.95178834246405      2.78637172044375
  H   -1.82487759670336     -6.55555627313949      1.31624442940288
  C   0.50912567030460     -2.47956231243988      2.42002903405882
  N   -0.58116233488855     -1.80242516897072      3.11440434124554
  C   -1.96082803652615     -2.13017861584047      2.74545191703199
  C   -2.33841471614906     -1.50588097965961      1.38663278218118
  C   -3.80661450086430     -1.67174322536800      1.07671520401883
  C   -4.78489469866450     -1.23934205648157      1.98585997086923
  C   -6.14150274075463     -1.41061259951753      1.71377646320601
  C   -6.55050677454818     -2.02442810736362      0.52632961306449
  C   -5.58963162484345     -2.45501893426708     -0.38998923134478
  C   -4.23106235611025     -2.27691054046772     -0.11356387692033
  C   -6.68775152616724     -5.99033290111477      6.17994212639741
  N   -6.76062732361526     -4.58988649525131      5.77610010717541
  C   -6.61608682639107     -4.32799293094381      4.34090799024225
  C   -7.91961048354429     -4.67632263952106      3.58568047665903
  C   -9.08509490876088     -3.81934228651442      4.00368628151802
  C   -9.84030846263222     -4.12244090924233      5.14593579162168
  C   -10.90474189862254     -3.30957229976697      5.53805787712778
  C   -11.23419475470454     -2.17277921547496      4.79445703396172
  C   -10.49476927294294     -1.86218731315680      3.65156874130834
  C   -9.43284393129828     -2.68199490654798      3.26195975214768
  C   -3.39699935328450     -6.76550224141733      8.16076304082431
  N   -3.19746000225711     -5.32894607220833      8.01522489124897
  C   -2.30281206489650     -4.87037029026456      6.95182671566004
  C   -0.82128995124351     -5.10856247662630      7.32534743402587
  C   -0.39680631364037     -4.29346303827356      8.51641599700042
  C   -0.26606895636496     -4.87192033778758      9.78535063221778
  C   0.10002659074403     -4.10237466445602     10.89152462547142
  C   0.33912723734809     -2.73402550529573     10.74505919402276
  C   0.21140763985117     -2.14390444565098      9.48465761617101
  C   -0.15220540428786     -2.91884227135974      8.38242807194339
  H   0.55567421245168     -3.57467653852934      2.58436568307724
  H   1.46433638873700     -2.05228718113154      2.75810207494710
  H   0.43658512424131     -2.29910959453964      1.33758041835554
  H   -0.48593143255125     -1.95965621986116      4.11938638704548
  H   -2.56365941686148     -1.62147047703210      3.50834770257109
  H   -1.73970146165980     -1.93687121644294      0.57001771733585
  H   -2.07470758336065     -0.43818027964271      1.44334830264408
  H   -4.48385949214194     -0.77070399039964      2.92561927271563
  H   -6.88312679790497     -1.06788091531254      2.43786499565624
  H   -7.61255501312073     -2.16007937846569      0.31255022202680
  H   -5.89679518822046     -2.92877281215596     -1.32452933924132
  H   -3.48266595224818     -2.61370158424454     -0.83581588120324
  H   -6.80099545287156     -6.05560725647707      7.27146016750098
  H   -7.51401170642785     -6.55930311254606      5.72839187027309
  H   -5.73718066013187     -6.48800456488265      5.90483474836257
  H   -6.01826729138342     -4.07325551634275      6.25231423066768
  H   -6.48793987069158     -3.23772369565933      4.26258666097362
  H   -7.73085609945860     -4.53025450253024      2.51164676905333
  H   -8.16848006950225     -5.73861156011422      3.73237027237637
  H   -9.58448211648689     -5.00309110471894      5.73736346188481
  H   -11.48025260296810     -3.56376935720019      6.43040930477543
  H   -12.06606413105269     -1.53644819339390      5.10159666267406
  H   -10.74718755364876     -0.98175819934474      3.05726224394277
  H   -8.86503971074491     -2.44115061014718      2.36083649205295
  H   -2.44362527074959     -7.25850325536501      8.40283522517795
  H   -3.82614305974748     -7.26313626665480      7.26822788462639
  H   -4.07882497423315     -6.94558210119597      9.00397325460679
  H   -4.10211052458900     -4.87460239010516      7.88210986592370
  H   -2.45044352341060     -3.78266263990643      6.91882687026800
  H   -0.21611916185124     -4.82941123588754      6.44846169242313
  H   -0.63755144108354     -6.17592269813335      7.51827801743585
  H   -0.45873161201131     -5.94062977357688      9.90609141712618
  H   0.19688617621881     -4.57253638282698     11.87213067963344
  H   0.62533938406818     -2.13014648297419     11.60796576553318
  H   0.39741881077839     -1.07552733090424      9.35898019608157
  H   -0.25171756619059     -2.44947603703976      7.39983887967421
  N   -3.94373201719886     -2.84162276078899      5.13419614650452
  N   -4.07630158854052     -1.76383548697651      5.75929018792199
  H   -5.05473748870601     -1.60189493918811      6.05496753082585
