74
Coordinates from ORCA-job orca
  N   -2.79066747720874     -4.34297188499846      1.28477790679589
  C   -2.64212588581282     -5.33675978355509      0.22921095208517
  C   -3.33520479288714     -6.62043365666433      0.65478524443767
  N   -3.27422079150108     -6.72279553302626      2.13664509796701
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  C   -4.69914139824430     -7.48174551328902      4.02111878556068
  N   -5.05742731016986     -6.07573002017483      4.07940975626297
  Mo  -3.92908057720016     -4.69049474936961      2.98799181685171
  N   -2.26466820035932     -5.29452359528006      4.27825676943476
  C   -1.62060839842530     -6.57207640548261      3.97820713778924
  C   -1.86715426399947     -6.97300626316641      2.54577682691299
  H   -1.97858593685135     -7.34585033145263      4.68400099288626
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  H   -1.61538397326789     -8.03365701401799      2.37661940654740
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  H   -5.07673495918936     -7.75110383051709      1.93922729892623
  H   -3.73664879525025     -8.76711479511017      2.54046307999597
  H   -1.56918237669813     -5.50762528139693      0.02776308404272
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  N   -2.94214988656324     -2.77119428011326      3.30042172920679
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  C   -2.05516570409855     -1.25672631268690      5.14821534819353
  O   -2.34611622790631     -0.59430461076763      6.11838342506690
  Cl  -0.30553172409895     -1.25368699804362      4.60073622697658
  C   -6.11241961930908     -5.67461928369869      4.82010601988874
  C   -6.90399877640187     -6.51071925333190      5.65335017559784
  C   -7.96354924113388     -5.98296767072723      6.37312361702975
  C   -8.27426334325677     -4.61384078355021      6.29173608362166
  C   -7.50780742431481     -3.77357611942003      5.49559557749814
  C   -6.40591666530798     -4.27561279280351      4.77431002501935
  N   -5.56811591845611     -3.53452433772164      3.94347177748848
  C   -5.83515574676928     -2.22994410546384      3.78362593204731
  C   -5.45914621780318     -1.44972875001600      2.64519214910108
  O   -4.99315723238252     -1.75906721180519      1.57479484192100
  Cl  -5.87567877828550      0.32880569751713      2.95418070174279
  C   -1.71834100595612     -4.70812835220832      5.41852941939676
  C   -0.31482602141902     -4.56549793559567      5.54643246382675
  C   0.28728927212760     -4.06991813417246      6.69011264760317
  C   -0.49881100333343     -3.70335001601172      7.79204585348020
  C   -1.87232766456072     -3.84741012897521      7.72074363997290
  C   -2.50676208098542     -4.34029553820556      6.55911950589750
  N   -3.88606299448816     -4.34683495304777      6.51147431806340
  C   -4.65225669896089     -4.87609335994224      7.39825159844135
  C   -4.23458207427504     -5.89915594860340      8.39197448993739
  O   -3.23038000025264     -6.54909190098046      8.43988499313648
  Cl  -5.60115876056927     -6.20901812791619      9.57882891513617
  H   -1.24471694747426     -3.46345303295395     -0.84250470818342
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  H   -0.91509035617302      0.52055039359436      0.76381580541709
  H   -2.13600995438426     -0.17317111261116      2.80238122938875
  H   -3.74764716685008     -2.49990621997881      5.17713791382379
  H   -6.66386363237486     -7.56767224057994      5.75508902172580
  H   -8.54903419580203     -6.63643561262214      7.02153575156094
  H   -9.11456351260729     -4.20670009417050      6.85436037093078
  H   -7.77430816411299     -2.71947426697210      5.44405848177449
  H   -6.48687526607770     -1.72594762987363      4.49396197453619
  H   0.30530049893373     -4.79910823857480      4.68026807516413
  H   1.36870686756402     -3.92939879154717      6.71373386295400
  H   -0.03988346489740     -3.28577157122724      8.68876484068872
  H   -2.50842289266507     -3.53407586585086      8.55037318243325
  H   -5.71970474981220     -4.64274382300157      7.38681237652094
  N   -5.40424850310488     -4.85100838363150      1.58230499148339
  H   -6.36672738159668     -5.03236533061935      1.86830108018604
  H   -5.38812049671964     -4.19279571052078      0.80326613703437
