78
Coordinates from ORCA-job /scratch/magstr/orcajob__5668072-uJ5O/orca
  N   -2.76010171346917     -3.73789994634091      2.56488650776963
  C   -2.37432300037188     -4.60772941330944      1.43949475966437
  C   -2.24817218999745     -6.03508308181152      1.94196706604712
  N   -3.40184491541062     -6.34897947426118      2.83140951065136
  C   -4.61151192609245     -6.74272824781613      2.05646883729992
  C   -5.83845823264508     -6.52715015262260      2.91789387627542
  N   -5.71715376039071     -5.21647908931887      3.57852999606880
  Mo  -3.94182715203767     -4.44587857824824      3.98033217782016
  N   -2.90923954984922     -5.43928579598015      5.34317855443985
  C   -2.26474215112240     -6.71292816712056      4.97348854856647
  C   -3.04956724403380     -7.37065224773255      3.85809335034113
  H   -2.21696700459392     -7.39703282320423      5.83337295049128
  H   -1.21937620520590     -6.50858567118693      4.67562614727550
  H   -3.98622619736446     -7.76406132327411      4.27269165828727
  H   -2.49135515742131     -8.20273855218590      3.39855321667803
  H   -6.73983488632935     -6.56600293067222      2.29166521441866
  H   -5.94648730724081     -7.31125562451142      3.68816981039202
  H   -4.67011990249262     -6.08561282206939      1.17815529242246
  H   -4.52601123583753     -7.78602949158277      1.71079420111694
  H   -1.41245130089371     -4.27843982577037      1.01607010223457
  H   -3.12557715572907     -4.52022672447672      0.63469517092786
  H   -1.33359592999739     -6.12465532768161      2.54307592091443
  H   -2.19244053616184     -6.76115327486244      1.11448907711190
  C   -2.20090110098883     -2.43938019401388      2.58863515350869
  C   -0.82696186402144     -2.33229169034120      2.83828646065168
  C   -0.19642382419752     -1.08895079228069      2.92648816977613
  C   1.25614089272095     -0.97695070039035      3.22051755632318
  O   1.89050423006213      0.05858051287579      3.17230314935380
  C   1.97562465485909     -2.26157166984840      3.68828958181694
  O   1.65234393455284     -2.88909659000666      4.65668246732148
  Cl  3.46993917739396     -2.56785548791162      2.78797679677031
  C   -0.93970798016014      0.08676727994275      2.73551037561354
  C   -2.29503954559829     -0.00099508073265      2.46391686062516
  C   -2.94875732257586     -1.24756206765377      2.38142784394597
  C   -4.38772265937426     -1.28749718071275      2.04468447971985
  O   -5.13708811305950     -2.22399250690317      2.00035188706457
  F   -4.86301028814856     -0.04824158760853      1.70479100813572
  C   -6.90611729564046     -4.66605821645901      4.11584672822422
  C   -7.04579398725235     -4.65710031024134      5.50908886013758
  C   -8.14389302894957     -4.05836068710643      6.13177129064046
  C   -8.23398153349362     -4.00332502886715      7.60977633285452
  O   -9.24245979387689     -3.77703943434289      8.24817337335643
  C   -6.89302646894495     -4.10281522697057      8.37919169397143
  O   -5.95282351910176     -3.38143342192429      8.16930007224891
  Cl  -6.90217924187280     -5.29702837564990      9.67346562213356
  C   -9.16988389766239     -3.49651869361863      5.35738188743963
  C   -9.04027476848408     -3.48617467587380      3.97794004582871
  C   -7.91792617355695     -4.04771061326296      3.33531889395200
  C   -7.88181656459936     -3.83058834757718      1.86573700831154
  O   -8.60271187731501     -3.12004432228601      1.23108849338385
  F   -6.93306535127364     -4.57683365886383      1.21072338053177
  C   -2.70748743984982     -4.99088805241837      6.66498893337863
  C   -1.99797754578257     -3.79987774590958      6.87511606202218
  C   -1.82544606355438     -3.27505556855604      8.15959061194994
  C   -1.13834322207545     -1.97896816202071      8.38436559835613
  O   -0.79275350183423     -1.56036426631045      9.47142557085737
  C   -0.93024690960465     -1.05403048817786      7.15806284551932
  O   -1.80072771506773     -0.75537566020269      6.38265224121183
  Cl  0.68768728698686     -0.36850452406321      7.08416181495647
  C   -2.30482057399282     -3.97763372650309      9.27734496170953
  C   -2.99026436323862     -5.16728332250258      9.09140768251932
  C   -3.22436378362179     -5.67485171681789      7.79928521458998
  C   -4.12702935775202     -6.83240750029957      7.63566158400829
  O   -4.72444221444281     -7.18859957181421      6.65721173111563
  F   -4.26154749995104     -7.54331605339926      8.79700993084272
  H   -0.26533399090454     -3.25366310071222      2.99528222461144
  H   -0.44193316651565      1.05363522950996      2.80876848541088
  H   -2.87283829838905      0.90783930916959      2.30556385551224
  H   -6.26370357885213     -5.13974428980261      6.09573709814622
  H   -10.03226710241449     -3.04565060862777      5.84805014638930
  H   -9.79785898231373     -3.01205015550930      3.35539283135130
  H   -1.58087766872634     -3.29486647489199      6.00236234475285
  H   -2.15065935647749     -3.56979405524441     10.27508141938569
  H   -3.39700189163962     -5.70101928786751      9.94934476422214
  N   -4.33537642049892     -3.05944526093143      5.00084914776011
  N   -4.61591801329172     -2.08273235932587      5.80435985618475
  H   -5.28228358691965     -2.29723028872893      6.55834095803494
  H   -3.84153207402681     -1.44218894337137      6.02518666434258
