87
Coordinates from ORCA-job orca
  N   -3.05580400408790      2.00706424461562      3.42606178603115
  Mo  -4.54960932471021      2.87274242625282      4.42386710249909
  N   -5.86294813619962      1.62593972289133      5.24148804290445
  C   -5.48027209316200      0.66454045377919      6.27134969631009
  C   -3.96763527084956      0.46136378149290      6.33502866489474
  N   -3.26687293264692      1.73870561399949      6.19197812032736
  C   -1.92695971939395      1.65357601580876      5.60981076985189
  C   -1.99921139471651      1.28286411876001      4.12936818078913
  C   -3.39213363783993      2.64850391465891      7.33181661531711
  C   -3.26654239230723      4.10065158436337      6.87385180890751
  N   -4.03076658144408      4.35635186877985      5.65596511369613
  H   -1.01918337118467      1.51729327594313      3.67206923349773
  H   -2.12928874166067      0.18797615122595      4.02370417519470
  H   -1.46741633860629      2.64794803615938      5.69607307478455
  H   -1.27770101267080      0.93687590242380      6.15207327463251
  H   -3.63140266440200      4.75282753208946      7.69019387039774
  H   -2.19855946162922      4.35854319728351      6.73655119390650
  H   -4.39270656292633      2.49805925754509      7.76114640215185
  H   -2.65041768438969      2.43049122480900      8.12628389804718
  H   -5.94065038210050     -0.32079841609484      6.06791146875866
  H   -5.87589016524765      0.98780956208658      7.25564567301833
  H   -3.66434699452553     -0.17187144354329      5.48938648363253
  H   -3.68908407002270     -0.06916433967030      7.26756070360595
  C   -2.85705636384622      2.02550067488304      1.98204843519932
  C   -2.96994438972856      0.65166873174928      1.27460731655781
  C   -4.37657817457671      0.15933684089507      1.08030530311632
  N   -5.09118934952178      0.80400108310367      0.16316228423527
  C   -6.34342597164552      0.35051379816993     -0.09685032734636
  N   -6.94241054227807     -0.70485823891264      0.42267383154571
  C   -6.24098424204119     -1.37193806445478      1.38531043749977
  C   -6.84440443715363     -2.48451717099983      2.02337265978252
  C   -6.18920253628042     -3.13604394077014      3.04691600842516
  C   -4.90601724826232     -2.71005109453182      3.46484605401583
  C   -4.28625648940205     -1.64496560713183      2.84276719273512
  C   -4.93246182914616     -0.95153440732329      1.78894460976356
  C   -4.30316288936383      5.76974965725027      5.43744443875821
  C   -3.06619785276437      6.61643603629214      5.03916024131481
  C   -2.53831596337175      6.21226417633981      3.69278946620636
  N   -3.29310240176784      6.55306003072103      2.65383863076158
  C   -2.89617447638348      6.14130339599138      1.42389696305360
  N   -1.82502214968870      5.43385365809499      1.11700709706625
  C   -1.01988275428066      5.08854016174672      2.16396046647166
  C   0.15186017336478      4.33312352328672      1.90565426259582
  C   0.98486928717461      3.96683192929926      2.94165979959511
  C   0.68721198824402      4.34904583215857      4.27113004252072
  C   -0.44597673475796      5.08571523070396      4.54943563449434
  C   -1.33379081227571      5.46365086228670      3.50984368716807
  C   -7.27594777525554      1.54063330301239      4.89104265255020
  C   -7.49398024979589      0.58431125093015      3.69819295329125
  C   -8.94055337244335      0.31619768161166      3.42855500989307
  N   -9.56518932004887      1.15236125806812      2.60488518214073
  C   -10.88396476935504      0.92874239355799      2.36865092182128
  N   -11.64256799245880     -0.03608511411959      2.85302969133704
  C   -11.02597748274866     -0.90495721262399      3.70996429383846
  C   -11.77693716197548     -1.96635921662210      4.27429786147893
  C   -11.17944186047260     -2.84945187237447      5.14929728320311
  C   -9.81433095409058     -2.70814028306589      5.49449595315108
  C   -9.05972117247186     -1.68642481919696      4.95520416486261
  C   -9.64365778950966     -0.76465410531330      4.04964786486765
  H   -3.58274157124680      2.71353367639931      1.53202860348400
  H   -1.84429055931046      2.41188688663430      1.76534520098454
  H   -2.34650780755967     -0.09438756524914      1.78370715014293
  H   -2.55041039786354      0.78979873054968      0.26634664600452
  H   -6.90831164977236      0.92395386908694     -0.83824310561102
  H   -7.84262282213377     -2.78058678315249      1.69835248900107
  H   -6.66617216171843     -3.98064656995127      3.54720131749043
  H   -4.40265297018838     -3.23318296994292      4.27975565524982
  H   -3.29392245030876     -1.33229827846548      3.16762094543644
  H   -5.04663704374253      5.86151266991929      4.63631185231363
  H   -4.72853972365674      6.21363113055234      6.35845115830162
  H   -3.40127325917573      7.66221535169781      4.97006827367021
  H   -2.29592267352832      6.56580315254161      5.81874359687516
  H   -3.55040563347855      6.43176523711159      0.59608475813167
  H   0.36429632458875      4.06024313555434      0.87092602737719
  H   1.88619574766939      3.38593457019280      2.73786264375352
  H   1.36375072795999      4.06445906735975      5.07871078285234
  H   -0.65201849784426      5.38802318317512      5.57601247870366
  H   -7.85480128069715      1.18981114672760      5.76531349080766
  H   -7.65556432164178      2.53377605518598      4.61870969893633
  H   -7.05746725775726      1.06321508467626      2.81259858370542
  H   -6.94964377394870     -0.34942504603582      3.89145520008097
  H   -11.36446349305685      1.63783173177297      1.68671396843416
  H   -12.82795767881374     -2.05430244481621      3.99545923158633
  H   -11.76121603336236     -3.66520909213043      5.58227318002809
  H   -9.35846674199161     -3.41398207212284      6.19089041115771
  H   -8.00733834959195     -1.58778828240408      5.22166209107645
  N   -5.43861165072251      3.64646837676034      3.23731194889434
