73
Coordinates from ORCA-job orca
  N   -1.82501869470092      1.08150772581956      5.44795643955172
  Mo  -3.36382956127090      2.39973108655353      5.09105758770059
  N   -4.76093245800761      1.95495571137160      6.52463252291994
  C   -4.46947812847637      2.37852466278141      7.89430364319996
  C   -2.96357284421394      2.36991149376445      8.06495821517793
  N   -2.32037370853672      3.11624223105365      6.93070117359211
  C   -0.87184140497282      2.76735429058938      6.81072484078094
  C   -0.70857516368507      1.31929368840747      6.32828463891596
  C   -2.49477824709038      4.59962516979701      7.13699562485275
  C   -2.80422896862998      5.27747357867996      5.81466632485001
  N   -3.76136728290038      4.42731266898838      5.12597393212524
  H   0.25595833465951      1.21263480867048      5.80657826852808
  H   -0.71458994357592      0.60452696755694      7.16699259939299
  H   -0.44232066114452      3.45798480036310      6.07395723704440
  H   -0.36339371402844      2.92316973271659      7.77658702954500
  H   -3.22282331778697      6.28145743126672      5.97622465498331
  H   -1.90015560515945      5.37210045635257      5.19097767259726
  H   -3.34942043540186      4.73561232945860      7.81032998741614
  H   -1.59973507254006      5.00928404602757      7.62863741417278
  H   -4.93597410710633      1.70089300551650      8.62708441474402
  H   -4.90750802597312      3.37526840906087      8.07914578096289
  H   -2.59878312729450      1.33552108122720      8.03231148015775
  H   -2.65261209469137      2.81737043516500      9.02293128734193
  C   -2.31404501601852     -0.00192845708392      4.87899956486963
  N   -3.47877899860315      0.31607416039372      4.28075705935113
  C   -4.33346142820965     -0.51657698613256      3.59370470616288
  O   -5.24608547571841     -0.05092129343644      2.91031488087182
  C   -4.13157714314061     -2.00024370981778      3.70768054420204
  C   -4.22453828376962     -2.78598076712031      2.55082731512486
  C   -4.08356211047790     -4.16941845273812      2.63465314084499
  C   -3.87420499138929     -4.79144335637087      3.86935782298305
  C   -3.80871719178486     -3.99979931539457      5.01449299575738
  Br  -3.55200196441072     -4.83122819804935      6.71586169307382
  C   -3.92764667622676     -2.61312254532727      4.95278458705682
  C   -4.97158516398317      4.85439574694878      4.75972075366760
  N   -5.49007704725500      6.01917273253946      5.07916845309891
  C   -6.73480144973298      6.27487999827979      4.50597566044943
  O   -7.16137012633489      5.74270692285113      3.47481147760836
  C   -7.56246991292638      7.28851914624508      5.24003851341491
  C   -8.79836086992951      7.67387627552042      4.70306806311122
  C   -9.59988009546137      8.59202683405546      5.37648379858530
  C   -9.19011549557273      9.12841657899901      6.60100497724483
  C   -7.96480606379169      8.72404363560323      7.12865716684865
  Br  -7.41340689909120      9.41117182839027      8.83086580383040
  C   -7.14055837331873      7.82138167342734      6.46684361857614
  C   -6.06021233652660      1.94428533961723      6.15336158974578
  N   -7.01174628169074      2.43676315839942      6.90224872712509
  C   -8.29587767661067      2.43553994574192      6.35817992007613
  O   -8.75032389344732      1.56341387929453      5.61491503905554
  C   -9.10278480514745      3.63653212878917      6.75537396128763
  C   -8.72300593475503      4.46442510004011      7.82144495341551
  C   -9.48277710719403      5.58862818958245      8.14062760447627
  C   -10.61324244253020      5.91442870929729      7.38931683272293
  C   -10.96957817237213      5.08921372650692      6.32174829841868
  Br  -12.48596523330070      5.56552801452594      5.25645610905868
  C   -10.24293595726145      3.94990231207284      6.00036944371800
  H   -1.84479005207604     -0.99483549595209      4.89983251847099
  H   -4.41231838583448     -2.29891839011200      1.59360535541454
  H   -4.14308623350292     -4.78016599998691      1.73254408986747
  H   -3.77302683964501     -5.87407679881241      3.93992712099520
  H   -3.90243921517738     -2.02018497514268      5.86714445708042
  H   -5.56818720039220      4.13081364064971      4.17170881836309
  H   -9.11524462808941      7.23195085371884      3.75846017208771
  H   -10.56346381708883      8.88741733192166      4.95838695396362
  H   -9.81711189260574      9.83940205365835      7.13879255022625
  H   -6.18360606815989      7.51318670029366      6.88366734633431
  H   -6.25717114954950      1.57237765800634      5.13236216968352
  H   -7.82923836634631      4.21323644173437      8.39054478143469
  H   -9.18910023535002      6.23421646044488      8.97001552488030
  H   -11.19858802168219      6.80399183691915      7.61811079216045
  H   -10.52338423268679      3.30520819845847      5.16785164028062
  N   -2.10600092539675      2.99607197997462      3.58026322673803
  N   -1.44833388590413      3.30398173738668      2.71739663562984
