75
Coordinates from ORCA-job orca
  N   -3.17007142948586     -4.17326173557622      1.79841143465979
  C   -3.62026770539435     -5.08897934471839      0.74888267592502
  C   -3.80244115548295     -6.47523228087281      1.36811551063893
  N   -2.95232307746620     -6.53067057156587      2.58464893269961
  C   -3.22870875286709     -7.70806422093152      3.44062220713744
  C   -4.60492308684495     -7.54459134754382      4.05128471262943
  N   -4.89064821914880     -6.11359310961450      4.14311173222174
  Mo  -3.49998834557350     -4.68755032149178      3.75291728909440
  N   -1.61619108072856     -5.25365448658263      4.32216652180053
  C   -0.71103446115363     -5.97910321846014      3.43236457406530
  C   -1.50687470820859     -6.47212738384604      2.23162662126517
  H   -0.25804476925899     -6.81405160197883      3.99017830626141
  H   0.11188037611380     -5.32990981628072      3.09202871218303
  H   -1.17715635565199     -7.47074154712128      1.90588372797727
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  H   -5.38318001651666     -8.01791604818579      3.43042082338315
  H   -4.63428946911908     -8.02377088066277      5.04299585987547
  H   -3.14736417250878     -8.63218358912195      2.84703290413373
  H   -2.45981278693348     -7.72838375032433      4.22226760161660
  H   -2.88693543408753     -5.11826032245539     -0.06951208704442
  H   -4.57521894490913     -4.73674112525916      0.32765675190056
  H   -3.50275566304183     -7.27143332886051      0.66769108159970
  H   -4.85440856090839     -6.62463129749245      1.64948870975166
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  C   -1.55863286269554     -1.44044336875160     -0.09491707259187
  C   -1.29345705887526     -0.55152465405803      0.97123629160078
  C   -1.58557831869653     -0.91549696366145      2.26884277270302
  C   -2.11218589006113     -2.19808193153359      2.53687757034247
  N   -2.48317538976483     -2.64236574191724      3.78468829557557
  C   -2.07014766667406     -2.07379157587636      4.90948597694962
  C   -0.80945998129747     -1.40779020201269      5.21906618108053
  O   -0.63947900375369     -0.67655310369291      6.15964964527873
  Cl  0.62260686750790     -1.94307803896465      4.22526938427956
  C   -6.14594978116887     -5.76265486607365      4.55456557661627
  C   -7.11629963757561     -6.64753127055050      5.07499171904195
  C   -8.36788996890830     -6.16228963487511      5.42168006698443
  C   -8.68972412004123     -4.80387571555928      5.23977045499055
  C   -7.75078623362598     -3.91984519763165      4.72923213301050
  C   -6.46388634591341     -4.38657930813494      4.39802580113309
  N   -5.44876078452637     -3.62201388356666      3.83416001606185
  C   -5.57799645975221     -2.28063320644085      3.90782233516138
  C   -5.10209189924961     -1.39871608286574      2.87733039477075
  O   -4.85406401258695     -1.65826741402585      1.72260393022021
  Cl  -4.97063081020856      0.30736492086912      3.48754541208185
  C   -1.16113643699962     -4.93720462005808      5.56339726926899
  C   0.17777700250366     -5.05301626293031      6.00892916280914
  C   0.50557420091524     -4.63992728285438      7.28591625202410
  C   -0.47335109235574     -4.08891342730644      8.14479589127146
  C   -1.78985514272292     -3.99112372363258      7.74107363534362
  C   -2.16002361305849     -4.45096238729603      6.45905529664939
  N   -3.43840239268434     -4.42643348610426      5.93652712865965
  C   -4.52412579623075     -4.32195853123855      6.73215573885230
  C   -4.67100237796149     -4.98410978489320      8.00429294928495
  O   -3.93907478023229     -5.75985037689118      8.57192784677997
  Cl  -6.31158978225002     -4.58072282571728      8.71411822330742
  H   -2.43423947978474     -3.28985117757632     -0.71786627160542
  H   -1.33234489218838     -1.13471987423217     -1.11716625271436
  H   -0.88814838136186      0.43884803108411      0.76440015787339
  H   -1.45016406261890     -0.20440248684831      3.08213728702583
  H   -2.72189252701668     -2.15038101856717      5.77762808939900
  H   -6.88211579323952     -7.70075431068469      5.22055800849999
  H   -9.11291721216035     -6.84377266351114      5.83354043902370
  H   -9.68870409423942     -4.44473234277320      5.48775326480016
  H   -8.02317434995501     -2.87973365712259      4.55176949904624
  H   -6.18239103315820     -1.83407376167368      4.70125936051558
  H   0.95203245829084     -5.41934559443031      5.33705483877513
  H   1.54121979158777     -4.70178560977955      7.62158508688903
  H   -0.18234052281693     -3.72040240682591      9.12854010575714
  H   -2.53652335322765     -3.53861826097510      8.39145631249252
  H   -5.42194143210052     -3.87022695663996      6.32518037617298
  N   -7.13664514425937     -6.11961061433433      1.42740829357471
  H   -7.20868484102706     -5.11945747523090      1.63443452036840
  H   -7.71982970894822     -6.58443151994686      2.12887826190523
  H   -7.61447589530122     -6.25442213342712      0.53229030425706
