90
Coordinates from ORCA-job /scratch/magstr/orcajob__5668035-JTx0/orca
  N   -2.93658067904954     -3.84923794622621      2.54309756442203
  C   -2.49608242569793     -4.80549202931328      1.52613575402582
  C   -2.02184058558901     -6.06738526218773      2.19439851674531
  N   -3.04397744114510     -6.48161695529089      3.18988170636524
  C   -4.22110990288749     -7.09295457842890      2.52364937272766
  C   -5.39864765424580     -6.88677570089623      3.43307383447025
  N   -5.39960470211930     -5.47632797717399      3.79006904846732
  Mo  -3.67152637466112     -4.57248508106143      4.29094165946396
  N   -2.10697360899483     -5.41692294406936      5.36404977576296
  C   -1.52828113174729     -6.71393993569536      5.04280661975326
  C   -2.48621805668869     -7.45301915462957      4.15885343999230
  H   -1.35312250898813     -7.30141888120013      5.95967841972580
  H   -0.53487336989382     -6.60343329297684      4.56990959553427
  H   -3.32308590615082     -7.84250157613742      4.75386629782410
  H   -2.01064859114528     -8.28934514523619      3.61726281287317
  H   -6.32178648831462     -7.17511657388055      2.91296141522911
  H   -5.34249684126814     -7.52209228023466      4.33855687332120
  H   -4.40441943786734     -6.56720722114073      1.57946902102352
  H   -4.01333999799146     -8.15292715131577      2.30719411676660
  H   -1.67023410520291     -4.38826241531007      0.92585634870636
  H   -3.31651297593201     -5.02491196101081      0.81502829895653
  H   -1.08314948742353     -5.87455429653028      2.72919637863424
  H   -1.85300701040894     -6.88248113421539      1.47013492761458
  C   -2.99542678540479     -2.47827936489735      1.97781530286344
  C   -4.15478685842331     -2.36787370675485      0.96101843755393
  C   -4.59617320658177     -1.00367115580808      0.53946343131266
  S   -4.81590025444714     -0.58687561169747     -1.04250511889065
  C   -4.76646934723469      0.04161396035580      1.57424562237293
  O   -4.23601431156012      0.00074174745120      2.69456299325686
  C   -1.63775431243965     -2.05563966038258      1.42398933530096
  C   -1.42204947064246     -1.79563317127154      0.06695944432095
  C   -0.15524440995595     -1.43370363824630     -0.40036174369611
  C   0.92708399919855     -1.32401193592636      0.47201599051674
  C   0.69521944247879     -1.58266667397717      1.81604042263279
  F   1.73222795456507     -1.47634676621350      2.69385200469014
  C   -0.55101696935065     -1.94318106913771      2.30389930965359
  C   -6.75544337724805     -4.86155994126180      3.87461728266408
  C   -7.03290036624209     -3.97945697712629      2.63587172828412
  C   -6.70719736087908     -2.52156517147410      2.86508146083368
  S   -7.36404494435679     -1.29487017823992      1.89034947841477
  C   -5.77541965553581     -2.15544379221411      3.84947421688225
  O   -4.88056726714612     -2.94126932517883      4.37317206859601
  C   -7.85498958665030     -5.87407844205777      4.16704021278310
  C   -8.11288658192521     -6.22952910355032      5.49874306335937
  C   -9.11906485304947     -7.14928218123897      5.81144988103757
  C   -9.88887461469118     -7.73918551526765      4.80321409927613
  C   -9.62038446502221     -7.37456274606698      3.48851082841081
  F   -10.35763405459919     -7.93557403380347      2.48767537854422
  C   -8.62872848827310     -6.45797612952461      3.14991397963195
  C   -1.62876024664874     -4.99215501878749      6.67759624883111
  C   -2.42345391124856     -5.70141529647501      7.81352327493999
  C   -3.79151270883622     -5.10937109227251      7.93175730682894
  S   -4.84180801756755     -5.01733439761677      6.60490521790407
  C   -4.18936927137082     -4.56687291119866      9.21549117015551
  O   -5.28226141903926     -4.06908115737853      9.50274643741146
  C   -0.10608743503295     -5.07447918356553      6.78119035474394
  C   0.65946606051273     -4.47134021436164      5.76673770246055
  C   2.05090872466723     -4.43258714680257      5.83724703171956
  C   2.72125414306976     -5.00959426370178      6.91675996608876
  C   1.95148607127402     -5.62872630307451      7.89520137305622
  F   2.57670309700997     -6.21443225475965      8.94604107042901
  C   0.56027015205987     -5.67165878531691      7.85329376051623
  H   -3.24909108203940     -1.78448995042069      2.78592478219794
  H   -5.02134979141842     -2.81071705703433      1.48246657576660
  H   -3.96646317612346     -2.97658047486760      0.07078780033997
  H   -5.30059860952202      0.93047352062359      1.20654627246547
  H   -2.24756183363289     -1.85968573693561     -0.64174516886524
  H   -0.01154657523204     -1.23203911549343     -1.46137825504692
  H   1.92309635440459     -1.04123179681451      0.13149693629059
  H   -0.65881126781582     -2.13722355425864      3.36727566325970
  H   -6.74368328586601     -4.20258111697990      4.75270129828786
  H   -6.46804511813133     -4.36921839561075      1.76961367628816
  H   -8.09261249718755     -4.03192760228645      2.35276180311731
  H   -5.73977181620683     -1.11217015250024      4.18393255202586
  H   -7.52388233475518     -5.76880300669792      6.29689817672867
  H   -9.31481388100108     -7.40452149772057      6.85458052205759
  H   -10.68463963064842     -8.45483971594326      5.02236972302246
  H   -8.47819136681063     -6.21005049132508      2.09770407648792
  H   -1.87855798793950     -3.94183164661890      6.84594039044794
  H   -2.44806107766226     -6.78415423852437      7.62135004292592
  H   -1.89722570707697     -5.55584968870273      8.77358974122543
  H   -3.38797879539462     -4.64851549579508      9.99905647900771
  H   0.15364576048536     -4.04915666636749      4.89563730465332
  H   2.62594799762715     -3.94557557770357      5.04502420609282
  H   3.80801408599978     -4.99088909396866      6.99838712976080
  H   0.02779357530668     -6.17024674996860      8.66069977391024
  N   -2.57274337283045     -2.72229827120529      5.19004940819858
  H   -1.60359172791898     -2.78997364306989      5.50147925482365
  H   -3.14754838498846     -2.37752952458698      5.95788794259366
  H   -2.61480226364024     -2.00925615623817      4.46089506783800
