96
Coordinates from ORCA-job /scratch/magstr/orcajob__5655535-9E2N/orca
  N   -3.51496340809671     -3.51390974508307      2.15113245703652
  C   -3.07522174093416     -4.43481244663473      1.09949945758069
  C   -2.60343584313380     -5.74154936441525      1.72293922965146
  N   -3.51245151982105     -6.14984023419760      2.81579316094662
  C   -4.78156118605412     -6.72823999477635      2.32201746670205
  C   -5.88518343328958     -6.52744065851099      3.35410237770162
  N   -5.83092577841575     -5.16231837309823      3.87550195915277
  Mo  -4.07347164382647     -4.22775079293998      3.91666128014040
  N   -2.54833645874757     -4.88376696964087      5.04829426897996
  C   -1.91325367029106     -6.15001458530982      4.68779202913456
  C   -2.84777294366732     -6.99303577170461      3.83092667110378
  H   -1.66243907587701     -6.74854268571271      5.57926730442020
  H   -0.95506160065189     -5.98262013191246      4.15222586717135
  H   -3.63403576797978     -7.41155498799246      4.47279093969161
  H   -2.30517769279628     -7.83352567045584      3.35780612658389
  H   -6.85046628795822     -6.73370403877894      2.85895706080093
  H   -5.79414069980885     -7.27631222650488      4.16630233935583
  H   -5.04873468697760     -6.18078019772021      1.40707517154403
  H   -4.65373880150348     -7.79613038337069      2.06220656220805
  H   -2.23280144009091     -4.02243519079882      0.51942992423407
  H   -3.88967830365634     -4.62566378921432      0.37180695346946
  H   -1.61446522937581     -5.57759176355555      2.17028455295040
  H   -2.51063549798018     -6.53949104153400      0.96247103955631
  C   -3.85155631197787     -1.77940271766658      0.36399843546128
  C   -3.48733432901623     -2.08627983987748      1.81971316332257
  C   -2.14292895657089     -1.41981604464553      2.25166591462420
  C   -0.90842183754746     -2.07517538751056      1.70493873733013
  C   -0.28958442170007     -3.11466867697100      2.41905019572249
  C   0.81846996746305     -3.77993783622522      1.89944310766453
  C   1.34576178328975     -3.42246215183770      0.65061625171846
  C   2.53616172395108     -4.12890111247845      0.09585394931796
  Cl  4.10235791346329     -3.32360514037440      0.60851593095653
  C   0.74355880015913     -2.37277173189205     -0.05755761250202
  C   -0.36500578268247     -1.70871458736063      0.46379017321494
  C   -7.94871292315710     -5.47460910672419      5.17470452794139
  C   -7.11310892339144     -4.57092737010339      4.26347890256295
  C   -7.91331454771839     -4.10936765901895      3.01243711220557
  C   -9.07947139132327     -3.22928762098899      3.35989743682672
  C   -10.39734021780321     -3.70864812735319      3.35051708588510
  C   -11.46346878494811     -2.89054217076455      3.72095323811147
  C   -11.24193251035161     -1.56406256647185      4.11407112923019
  C   -12.37942531766336     -0.68907648363781      4.51722220235314
  Cl  -12.70297419705083     -0.78621435739411      6.32191557360796
  C   -9.92632732570683     -1.07786256340025      4.12448535915763
  C   -8.86413188164186     -1.89751983182989      3.75266078144324
  C   -0.58535011761188     -4.46027783060825      6.55634138348633
  C   -2.07722895143252     -4.24642859591842      6.28132687719782
  C   -2.96492032629912     -4.61979803276507      7.51506342031766
  C   -3.18135564571375     -6.09101266230534      7.69945839516357
  C   -2.28978027346354     -6.89214833441560      8.43068658878823
  C   -2.45964620926193     -8.27378480561014      8.50407699848062
  C   -3.53636263472074     -8.89627244977918      7.85644299431503
  C   -3.69930756632542    -10.37642536447352      7.89958178978561
  Cl  -2.89773159441981    -11.17999224016500      6.45244000644077
  C   -4.45195847866660     -8.09759329599947      7.15766006238561
  C   -4.27686851767441     -6.71817544657815      7.08156058614144
  H   -4.81693505009981     -2.23841084270711      0.10655811479045
  H   -3.94074497820791     -0.69278290635717      0.22225675834949
  H   -3.09698138181560     -2.14816566264344     -0.34451323807687
  H   -4.25865947485893     -1.60529603488320      2.44525928216056
  H   -2.17615467741933     -0.35793349162270      1.95759500173631
  H   -2.10303780277227     -1.46096698221414      3.35146900189948
  H   -0.70428925377883     -3.41132972954967      3.38542773045753
  H   1.28666844736105     -4.58604092539034      2.47013888665137
  H   2.55470798965947     -4.11562180759780     -0.99927672045616
  H   2.61458180221991     -5.15946757094748      0.45876750471977
  H   1.15436264641161     -2.07381333641952     -1.02484279182292
  H   -0.82045193054151     -0.89195400601912     -0.10068857184889
  H   -8.85295616599307     -4.94680578501739      5.50887494193845
  H   -8.27034580829419     -6.39239960622775      4.65963586912771
  H   -7.37106545481303     -5.76240513120533      6.06472491643829
  H   -6.85663945305995     -3.66066971799540      4.82687572503804
  H   -7.20617329466884     -3.56055932239035      2.37098960132149
  H   -8.26167095148631     -4.99024611034537      2.44910961076756
  H   -10.58718346276470     -4.74012971474538      3.04421121776774
  H   -12.48309868882760     -3.28304491395203      3.70557700581441
  H   -12.17994448680468      0.37014853424346      4.32244156638572
  H   -13.32143987579747     -0.98591509542194      4.04379039267868
  H   -9.73922552121841     -0.04448771447397      4.42636751951999
  H   -7.84479705758563     -1.50282464347949      3.76019905335706
  H   -0.27382604244501     -3.83505367072855      7.40544782325317
  H   0.01620503650527     -4.16861244747012      5.68293590827876
  H   -0.34358936252690     -5.50330930708837      6.80389173885974
  H   -2.22686337732064     -3.16353804002463      6.15425898815350
  H   -3.93581364946865     -4.12787730058610      7.35471514622375
  H   -2.50557494476384     -4.17822237038899      8.41404960461644
  H   -1.44816395068224     -6.42448223697652      8.94682521516623
  H   -1.74751961080000     -8.88217660762489      9.06676467226800
  H   -4.74877721885947    -10.68514404522284      7.84508088884843
  H   -3.21966211993750    -10.82673809098184      8.77507097756277
  H   -5.30622655076120     -8.56712848894163      6.66286739699515
  H   -4.98831668446497     -6.10805088370179      6.52110190341607
  N   -4.50614965134202     -2.78287442563699      4.96166800622750
  N   -4.24895674262740     -1.51257140659718      5.31257495375137
  H   -3.94322206369464     -0.87917142583790      4.55856643338442
  H   -4.95550568320564     -1.08267454782100      5.91269206550302
