122
Coordinates from ORCA-job /scratch/magstr/orcajob__5655498-z3xf/orca
  N   -3.32579011709819     -3.12775803950250      2.04523251022667
  C   -3.67508324064983     -3.87909583358080      0.82937050065574
  C   -3.29609912314575     -5.33788384295436      0.96006230289627
  N   -3.80762567017676     -5.87824099561911      2.23370821402454
  C   -5.24468467021828     -6.22247732960460      2.17771212695675
  C   -5.85279019882520     -6.00133840369409      3.55477968779304
  N   -5.51561585037070     -4.65346833251072      4.02831448865305
  Mo  -3.60981292283099     -4.14833301131822      3.78343768067567
  N   -2.40915008366595     -5.59248039506656      4.60229225222978
  C   -1.83270022764357     -6.40567858994887      3.53516960437479
  C   -2.96439007122423     -7.00204228140462      2.70434881266319
  H   -1.18403243876445     -7.21127818952240      3.91474335092912
  H   -1.18426375666121     -5.79437412376910      2.87863248811661
  H   -3.57489450601663     -7.65234651823872      3.34408757550345
  H   -2.60598587924754     -7.59681242968155      1.84318615821465
  H   -6.94134910291720     -6.15236624507437      3.48034330468142
  H   -5.48044942688253     -6.77044996975755      4.25797888611846
  H   -5.72796777366233     -5.54568931202729      1.46058033330062
  H   -5.38539070413138     -7.26012022800520      1.82170347560867
  H   -3.14640279387736     -3.49587747109684     -0.05805761274740
  H   -4.75619675799199     -3.78679222841593      0.59895889837253
  H   -2.20028707817178     -5.41779733357382      0.98557014587922
  H   -3.66422027153694     -5.93396998406914      0.10295629364999
  C   -3.70441952095317     -1.06307655579026      0.69359357560637
  C   -2.78453376044194     -1.77693950358811      1.70914269321130
  C   -2.71562273648454     -0.86639051543041      2.93412962395785
  C   -1.35941782399865     -1.91603260510350      1.10485137480242
  C   -0.33691801851946     -2.55753754381496      2.04200511910830
  C   0.92834491787526     -3.09189075435952      1.36238770365168
  C   0.67434835766977     -4.30060682128777      0.45512431087357
  C   1.93327643907238     -4.66586189409842     -0.35715171584162
  C   3.23365649700094     -4.36595413366347      0.41874461502910
  C   3.00638565976797     -4.51325404797519      1.92406247614720
  C   1.98095127992601     -3.47746855273686      2.42596904636935
  C   -6.17987397564025     -2.51527820189852      5.07442343292752
  C   -6.66286883924843     -3.86871468643661      4.55014771150272
  C   -7.32445253743500     -4.62211667185446      5.71993428140739
  C   -7.72461625123270     -3.62512562671683      3.44120002093093
  C   -7.23640887947942     -2.77440050738841      2.26798076977303
  C   -8.11427994162604     -2.81706689060986      1.00812493918804
  C   -9.57312259410548     -2.41971582741216      1.25972637014919
  C   -10.32196227063205     -2.19026358257705     -0.06914638839741
  C   -9.80876646122706     -3.11596132714467     -1.19375886605408
  C   -9.28555440919841     -4.43185157103752     -0.61504694831627
  C   -8.06201988950431     -4.18515507540911      0.29046052393958
  C   -3.10617119723990     -5.42178585854562      6.98997445303138
  C   -2.24316873255859     -6.16458582297766      5.96107007520024
  C   -2.71481252731100     -7.63730214264488      6.00782275943177
  C   -0.74941647497574     -6.11921754136832      6.38835040305340
  C   -0.13001510684985     -4.72179187210581      6.38903379462110
  C   1.39961283705204     -4.69903804205324      6.32535677973721
  C   2.07068552346618     -5.42617889468145      7.49823457589494
  C   3.59913739334538     -5.38358429623019      7.39944450916910
  C   4.12010085219825     -3.94817557861541      7.28270800396089
  C   3.45109659245021     -3.21035658389031      6.11943461708184
  C   1.92601598562305     -3.26044276593719      6.23592798967222
  H   -4.73246510264149     -1.02109048561900      1.08359019791811
  H   -3.72833852553024     -1.55455911522415     -0.28803861933155
  H   -3.35343486332299     -0.03268130420488      0.53685029562311
  H   -2.32887261353151      0.11764851734805      2.63040302600493
  H   -2.06956994340872     -1.27940332555522      3.71444783674023
  H   -3.71950065531521     -0.72079975776569      3.36109322405113
  H   -1.42893030718157     -2.50282313569828      0.17471241754541
  H   -1.01194512909645     -0.91391448661221      0.79978442422841
  H   -0.82035255650402     -3.39176429195283      2.58146727013498
  H   -0.03706810229103     -1.83375435823265      2.81807938414907
  H   1.34627112665075     -2.28444279451775      0.73116090164504
  H   -0.16978851509622     -4.11648191683710     -0.22644297307001
  H   0.37204649662831     -5.15027962440919      1.09379967048619
  H   1.89670774740609     -5.73393782222140     -0.62508641961025
  H   1.93597368516632     -4.10810415036544     -1.30720577277728
  H   3.56789919255701     -3.33597668375412      0.20929347166464
  H   4.04311344295185     -5.02771733741974      0.07505285953561
  H   2.63966899528000     -5.53330319901120      2.12947774108854
  H   3.95203486951330     -4.41139598886292      2.47820289934060
  H   1.45562649104469     -3.87995615675188      3.30751486434149
  H   2.49762805743409     -2.56571743589991      2.76731188868216
  H   -5.49699263604490     -2.64592188029884      5.92226189563541
  H   -5.64398591637821     -1.95429932893586      4.29590991349510
  H   -7.04608549736678     -1.91817241403241      5.39668244401405
  H   -8.14175278624288     -4.02287431063117      6.14767560230728
  H   -6.58353055573916     -4.81387778174521      6.50950471251146
  H   -7.74825616506506     -5.58570738738710      5.40248643007620
  H   -8.59606995832300     -3.14625829397271      3.91775895227953
  H   -8.08916447948714     -4.59930374218250      3.07695779515037
  H   -7.15317818778587     -1.72376671895827      2.59118931302256
  H   -6.21393037890145     -3.09056489809550      2.00322952092002
  H   -7.69315881154474     -2.06429203854829      0.31631891078971
  H   -9.62131874945921     -1.51362172471896      1.88480342486882
  H   -10.06801512076833     -3.21744508803368      1.83862256527885
  H   -10.21016017578409     -1.13979184829643     -0.38125349940139
  H   -11.40020751538834     -2.35417050988523      0.08590008947614
  H   -10.60720427910539     -3.30095427237781     -1.92817294874600
  H   -8.99168496771579     -2.62161857324358     -1.74573699037915
  H   -10.09125555857123     -4.90754578748755     -0.03063311220566
  H   -9.02884730215543     -5.14074373217660     -1.41697295779295
  H   -7.13405225545555     -4.23872382376486     -0.30293878023561
  H   -7.99870949395429     -4.99400174478885      1.03630169387350
  H   -3.12963403153626     -5.99834232868121      7.92612371036190
  H   -2.72884452589801     -4.42293927423857      7.23030097963642
  H   -4.13471879715981     -5.31098956205494      6.61835225449596
  H   -2.16732915534270     -8.28321466369397      5.30752333369065
  H   -2.55941112659662     -8.04640769340467      7.01735022767279
  H   -3.78816635040555     -7.70143902133788      5.77466022575293
  H   -0.65824549034466     -6.58913749701368      7.38167648959996
  H   -0.17613940612775     -6.76386100567694      5.69844825795103
  H   -0.45453733953178     -4.16114808105429      7.28375159431295
  H   -0.52220023734583     -4.17470551850610      5.51503788397725
  H   1.69869309879299     -5.22346239808801      5.39489003981648
  H   1.74937004509954     -4.94303683395061      8.44013841566234
  H   1.72608588081860     -6.47101760087068      7.54764332144485
  H   4.05145422030142     -5.88593394040665      8.26952292233623
  H   3.91631548351606     -5.95424693971931      6.50800054776224
  H   5.21512902536269     -3.94699263378455      7.16111089881414
  H   3.90688864270276     -3.40755275664389      8.22253362389040
  H   3.79825020633920     -2.16563308560548      6.07599618021980
  H   3.75380621942363     -3.68340272353743      5.16807253049378
  H   1.45639071832607     -2.74531969344416      5.38261664142948
  H   1.61048485811201     -2.71385110062474      7.14412371230791
  N   -3.02690114334625     -2.82567722926816      5.18744296707708
  H   -3.32379890241957     -1.85602696115436      5.28199080661777
  H   -2.45436061329076     -3.07809932029032      5.98844076174942
