122
Coordinates from ORCA-job /scratch/magstr/orcajob__5658497-cBPJ/orca
  N   -2.94386943771953     -3.76916459989371      2.62330689023749
  C   -2.94300081648366     -4.83462850140436      1.61251271771172
  C   -3.41252032097017     -6.12960042326679      2.26432765476423
  N   -4.59291857153667     -5.85679313060192      3.14421921458478
  C   -5.84504189497195     -5.68000393503233      2.34686639631221
  C   -6.85115386050701     -4.81445258143806      3.09962763858340
  N   -6.14594290363927     -3.66887266669926      3.66172599917096
  Mo  -4.23391119575927     -4.01411142212936      4.10876551485086
  N   -3.65404138377952     -5.19901411327741      5.58891310352726
  C   -3.73781235433490     -6.63407323237298      5.34104414464298
  C   -4.74994833170949     -6.87553808292322      4.22235632966694
  H   -4.09007037882096     -7.19573904822737      6.22657754868958
  H   -2.75437975690527     -7.07178541548945      5.06952267819268
  H   -5.76627325734272     -6.75291633919623      4.62104616946297
  H   -4.65739251157785     -7.89644088549829      3.80757386219484
  H   -7.63824503493476     -4.51998464120508      2.37903052292453
  H   -7.36438384547197     -5.41712626284671      3.87769204278482
  H   -5.55634889892361     -5.16885272820755      1.41854621004799
  H   -6.26694044413696     -6.66642495744604      2.08500976753279
  H   -1.93633275482455     -5.01930229540808      1.19235249305612
  H   -3.59170273784843     -4.59014009419491      0.74467567473757
  H   -2.61983097316723     -6.51776573425781      2.91880077348219
  H   -3.66015826674066     -6.90278404548646      1.51481940443196
  C   -0.85200372256916     -2.64554260687045      1.79551489644426
  C   -2.32584348984292     -2.50730933980501      2.20025336646875
  C   -3.16662852281954     -1.80542871262756      1.11681401613521
  C   -2.83234534203098     -0.31901391053126      0.91802586245976
  C   -3.78983054599316      0.34721241180624     -0.03395551559939
  C   -5.09326272134127      0.67459750582883      0.37061243404256
  C   -6.00274481539593      1.24537665000400     -0.51566030878854
  C   -5.64495768901039      1.51553470514049     -1.84902480072193
  C   -6.60772408478512      2.12636179427271     -2.79148911693145
  C   -6.17909189209120      3.03397117096236     -3.77677015430967
  C   -7.08618434051128      3.60966987620196     -4.66587182525953
  C   -8.44473293158212      3.29194317929486     -4.59066299654291
  C   -8.88603798661098      2.39226473871288     -3.61700292882072
  C   -7.97828409476475      1.81660625416480     -2.72842682354290
  C   -4.33957286039319      1.18891149583313     -2.25286755334085
  C   -3.43340901825028      0.61533315296869     -1.36209374110998
  C   -7.87547080643620     -1.92398246152514      3.19275913469789
  C   -6.95810960735333     -2.59172939483640      4.22450611311496
  C   -7.75273114542143     -3.04524321146669      5.47040143329126
  C   -6.83568751204179     -3.46741525520537      6.62766907105176
  C   -7.39468874868913     -4.51277347014504      7.55118541394205
  C   -7.84105646522570     -5.74921438333062      7.05489219982737
  C   -8.34615250022176     -6.73184159557734      7.89985452029829
  C   -8.42333814016856     -6.52891728827927      9.29033942894389
  C   -8.97253350896818     -7.56726310739361     10.18673906180763
  C   -8.83188086554783     -8.93509966041559      9.88735198946899
  C   -9.34189532413307     -9.91464919000478     10.73882646930613
  C   -10.00582570219019     -9.55135643672762     11.91340193492855
  C   -10.15398342144690     -8.19814080128189     12.22496162164132
  C   -9.64491919890974     -7.22026508021011     11.37277575358097
  C   -7.95531781525821     -5.30229979913472      9.79104674672754
  C   -7.45463430002792     -4.31901836248216      8.93915144517878
  C   -1.36233734627481     -5.17000435134814      6.61569633920137
  C   -2.83024080255744     -4.73155430993920      6.70614190599114
  C   -3.46937201578499     -5.00918472200879      8.09243250052628
  C   -3.06576802737095     -6.31478150596258      8.80161090865605
  C   -3.92828540798056     -6.58558734610864     10.00796038015885
  C   -3.93291511071938     -5.71631526445819     11.10985704539727
  C   -4.77143376934388     -5.93779875694759     12.19895237161227
  C   -5.63529262569290     -7.04691267908179     12.23595998139031
  C   -6.54842857493561     -7.26932348383502     13.37717950031438
  C   -6.84912207923269     -8.56743651671823     13.82377940711338
  C   -7.72310921372808     -8.77485284308953     14.88951083573549
  C   -8.31904937480074     -7.68833886700462     15.53436043168119
  C   -8.03030277048260     -6.39127717962501     15.10222845883683
  C   -7.15465178388871     -6.18505856514103     14.03676105214970
  C   -5.61502996176766     -7.92758111694087     11.14342941641948
  C   -4.78337658105744     -7.69399891025011     10.05006899993885
  H   -0.29141969411304     -3.18187607260789      2.57500974865559
  H   -0.38684723414977     -1.65874237628408      1.65795912078076
  H   -0.74223547456600     -3.19635631877569      0.84893231622478
  H   -2.36354375900407     -1.86170850443086      3.09911740517520
  H   -4.22517649795184     -1.89339518639460      1.41512624649065
  H   -3.06343993395124     -2.33082335099722      0.15233789826185
  H   -1.80367204885285     -0.20535409417382      0.54325190392869
  H   -2.87427262493447      0.18436675597272      1.89954078933405
  H   -5.39721422181454      0.48607723273702      1.40389024698893
  H   -7.00016110625757      1.51414472690662     -0.16219321438800
  H   -5.12400218273089      3.30891063627065     -3.82838987761624
  H   -6.73113513755108      4.31810810349123     -5.41673265323043
  H   -9.15480345437042      3.74253980609025     -5.28606222265040
  H   -9.94385947261574      2.12999999681561     -3.55415179409189
  H   -8.33073247741526      1.09625371563386     -1.98786446824188
  H   -4.03659744972402      1.36589796875609     -3.28668629618020
  H   -2.42669884854474      0.36423002907504     -1.70617239605005
  H   -8.67720385322597     -2.60287408846781      2.86428773693081
  H   -7.30005809490180     -1.61770412550743      2.30697012111106
  H   -8.35539754458852     -1.03253142825629      3.62306841184066
  H   -6.23074427783590     -1.82645161577116      4.56233563708953
  H   -8.40906002803958     -3.88126627926264      5.18094865952684
  H   -8.42267019794830     -2.23196299029719      5.79310962118055
  H   -6.53836893181290     -2.58252728698100      7.21186124693622
  H   -5.89714265904098     -3.86334970944678      6.17610120443477
  H   -7.80228578024409     -5.94131649030194      5.97962041504094
  H   -8.71204494850610     -7.66731523310490      7.47212541991594
  H   -8.28941011794611     -9.23486584044577      8.98881199284337
  H   -9.21012594627734    -10.96925730496517     10.48862154862109
  H   -10.39785207233832    -10.31709336837038     12.58476483897228
  H   -10.66389799750255     -7.90043608532899     13.14253495992050
  H   -9.78194211517501     -6.16699924561046     11.62218208070482
  H   -7.95709848365504     -5.12669099400599     10.86810655467343
  H   -7.09083594808409     -3.37874799522967      9.36129686485283
  H   -0.94140024794483     -4.86560813978859      5.64641109207805
  H   -0.76528376949812     -4.70623283435321      7.41551834640170
  H   -1.25147758443207     -6.25972263852515      6.70932362544381
  H   -2.83895218007111     -3.62858332181242      6.59622467271932
  H   -3.22537479347118     -4.16981161211047      8.76415075771159
  H   -4.56190176659839     -4.99083862912267      7.96386070685441
  H   -2.00788870623221     -6.25304454395396      9.10633639193574
  H   -3.14026316718333     -7.16980152816533      8.11405009198520
  H   -3.26532076799204     -4.85103828766459     11.11648621516844
  H   -4.74176743684736     -5.25283104893189     13.04875428177074
  H   -6.38032587808871     -9.42290477902813     13.33451748146970
  H   -7.94002266011934     -9.79257668124483     15.21946004211125
  H   -9.00526057830700     -7.85094018939838     16.36727485726577
  H   -8.49725888829767     -5.53463215470882     15.59217404825703
  H   -6.95564129416417     -5.16932753363331     13.68948598994099
  H   -6.29533543000927     -8.78014690291287     11.12868809342925
  H   -4.80907773731479     -8.38051947375338      9.19989780236516
