95
Coordinates from ORCA-job /scratch/magstr/orcajob__5655530-UhI6/orca
  N   -3.29832415348922     -3.56666203363078      1.64993634942980
  C   -2.70587176384323     -4.56333618453976      0.74756070401573
  C   -2.40846723044684     -5.82067102284405      1.54074396806344
  N   -3.54037311766817     -6.07389929321925      2.46132494288326
  C   -4.70666216900399     -6.62271820794297      1.72790006848738
  C   -5.95986098470989     -6.40135030389009      2.55024492024276
  N   -5.85180228584655     -5.12277889903761      3.24418659785596
  Mo  -4.19206158777983     -4.07840282371011      3.32026179518798
  N   -2.94391876690128     -4.69101042232091      4.69992715320723
  C   -2.34120993279703     -6.02757434659365      4.59521556150918
  C   -3.15619166123350     -6.88507828452249      3.64339549350131
  H   -2.31377971772270     -6.52764557025099      5.57484877282185
  H   -1.29336548440906     -5.94478946524930      4.25257103490481
  H   -4.08111350296394     -7.19930430866533      4.14409797741840
  H   -2.60191215338222     -7.78890798858829      3.33915045498373
  H   -6.84220774857932     -6.42484962605381      1.88759877851280
  H   -6.09621760670083     -7.21785856116234      3.28084614755445
  H   -4.77814061588545     -6.07222734633401      0.78104368243549
  H   -4.55560143807378     -7.68994328105917      1.49420315994218
  H   -1.76435880783622     -4.19185678120258      0.31881678425686
  H   -3.38351916410179     -4.76603808631400     -0.10043702421080
  H   -1.50962289806524     -5.65653249542116      2.14742364505094
  H   -2.23308829189363     -6.69237445148788      0.88758274936474
  C   -3.08683040778720     -1.89223448761812     -0.19634971534929
  C   -3.02241230594839     -2.14504089978595      1.31041017167253
  C   -1.71806965037861     -1.61157637652086      1.96210007953563
  C   -0.45847231653065     -2.34922433688818      1.60190581819053
  C   -0.01360344215523     -3.41191416177718      2.40183126047471
  C   1.12647169726623     -4.13879972909068      2.06843760426916
  C   1.86323435403153     -3.81704605117121      0.92045619616256
  C   3.10114914449591     -4.57724608420711      0.57159350615561
  Cl  4.56149284923270     -3.87532388354631      1.41069182086642
  C   1.43375019408478     -2.74598708109328      0.12553989836113
  C   0.29119753745132     -2.02116844664824      0.46227893733384
  C   -7.79656808423766     -5.89154165973097      4.66465819876407
  C   -7.04735542563518     -4.71945478528442      4.03123810153294
  C   -7.97451613196214     -3.85698803508540      3.13807671194739
  C   -9.11270208350145     -3.24602489904132      3.91096190817783
  C   -10.42122137455676     -3.73052627342513      3.78935488172765
  C   -11.45811759334937     -3.18732287276778      4.54719820349922
  C   -11.21211200474136     -2.14417869547404      5.44837734831907
  C   -12.31649399381306     -1.58012546520695      6.28076530108164
  Cl  -12.42817024780890     -2.44078650113917      7.88845945071573
  C   -9.90537928412438     -1.64973743386933      5.56628223048058
  C   -8.87223793960565     -2.19436743278513      4.80818044947880
  C   -1.05386404378841     -4.08294555770727      6.24471086734322
  C   -2.52083424557478     -3.87468756266226      5.86213141911055
  C   -3.47786028663826     -4.06100621880542      7.07919900953868
  C   -3.67288218307952     -5.49489581007268      7.48182026293597
  C   -2.76648499315192     -6.16537287263493      8.31611419722798
  C   -2.89042444966135     -7.53559440281132      8.54669319912090
  C   -3.93260827467969     -8.26758604235801      7.96278103222530
  C   -4.02618957250008     -9.74563383408267      8.14832397805346
  Cl  -3.27903712766826    -10.61788136207057      6.72269804466542
  C   -4.87656500325628     -7.58828915271707      7.18004349960457
  C   -4.74566654421760     -6.22306368147769      6.94722503764718
  H   -4.02946138325292     -2.27046728714705     -0.61555609450835
  H   -3.04485111112101     -0.80918110278972     -0.37688313995195
  H   -2.25269107026447     -2.35155715155229     -0.74204269408073
  H   -3.83238206374108     -1.56311430757550      1.77186046069670
  H   -1.62908421612974     -0.55019879509162      1.68138664551091
  H   -1.86032738989423     -1.64745297258321      3.05360275500583
  H   -0.58303129108228     -3.66904074355330      3.29680844870769
  H   1.46184903496673     -4.95711942620706      2.71053041325574
  H   3.32586621679365     -4.53151151568417     -0.49944878186520
  H   3.05154370283322     -5.62217074029862      0.89714989640801
  H   2.00911859613009     -2.47120829257396     -0.76129680927421
  H   -0.01780989476013     -1.18206417737942     -0.16473662519150
  H   -8.56438412610253     -5.49867534923638      5.34360811181963
  H   -8.30493788530883     -6.51204399679739      3.91335621515528
  H   -7.12455250434854     -6.53409997804787      5.24833827456666
  H   -6.68828973066207     -4.07406367946767      4.84545331138623
  H   -7.35782876136561     -3.06460564871134      2.68583063611571
  H   -8.36126636287042     -4.48015583069300      2.31702190794615
  H   -10.62990121449493     -4.54365013081772      3.09028065029208
  H   -12.47228609343193     -3.57888532080214      4.44209825206997
  H   -12.15532468169056     -0.52476048986650      6.52573249391151
  H   -13.29723272066460     -1.70836181469108      5.81049585968496
  H   -9.70138341405719     -0.83265492666707      6.26188007627088
  H   -7.85918627110648     -1.79522014394598      4.91102293742987
  H   -0.78630225775846     -3.36878128508869      7.03546957557019
  H   -0.38729613692504     -3.90230261240221      5.39125489372525
  H   -0.85984041016312     -5.09383040979161      6.62567893680873
  H   -2.61658687011060     -2.82037794903253      5.55720642815832
  H   -4.45343320893570     -3.62729109155987      6.81146369371878
  H   -3.07045760368804     -3.46888308851114      7.91344518223001
  H   -1.94821916309030     -5.61213244297465      8.78113512689018
  H   -2.16564900794355     -8.04785618606724      9.18316808020985
  H   -5.06179595038274    -10.09984607890761      8.19178286701760
  H   -3.47404233942169    -10.09291250579092      9.02772302595776
  H   -5.71223750155063     -8.14273779006255      6.74552988834098
  H   -5.47816278667735     -5.70124317366988      6.33039984402640
  N   -4.75828584857988     -2.34445626307833      4.01573074648356
  H   -5.41102621315710     -1.70469866111593      3.55173278243589
  H   -4.46844774886576     -1.92074576616863      4.90192909877330
