121
Coordinates from ORCA-job /scratch/magstr/orcajob__5655463-b5rZ/orca
  N   -3.18878650742513      4.58521965522330      5.31755797180806
  Mo  -3.27712247824759      2.90519425443691      4.07922710247050
  N   -4.19019762139225      1.47483784633058      5.35886472419712
  C   -3.24113495983416      0.83680161458123      6.25635305970111
  C   -2.27085148977599      1.89092061556844      6.74152611962815
  N   -1.59949478361903      2.55816833130972      5.57957340592457
  C   -1.05082977219866      3.88635968722481      5.99504383742843
  C   -2.20540256202355      4.82777062120002      6.33395417622388
  C   -0.50315912859884      1.65697176764938      5.05381721228486
  C   -0.67153026264912      1.38267229746765      3.55544975302953
  N   -2.08276842221721      1.38579789415382      3.34016813110439
  H   -1.83776779698830      5.87012553801676      6.32528886681143
  H   -2.59818209105062      4.64176726457057      7.35263698184762
  H   -0.49294792946575      4.27935206188577      5.13488279871579
  H   -0.35643414584453      3.76423594336022      6.84423513458520
  H   -0.19392839018308      0.42192138522096      3.29323292889186
  H   -0.17751165152359      2.17320314258805      2.95776376380285
  H   -0.57426207784291      0.70718668046423      5.59875289716962
  H   0.47367734008732      2.10576937049086      5.28309063006849
  H   -3.74194279301229      0.40444791701467      7.14105450133542
  H   -2.69817073906295      0.00441366763284      5.76096822908131
  H   -2.83713565379218      2.65195884060295      7.29092527436843
  H   -1.50511199865072      1.47116929966748      7.41615364038179
  C   -10.31975783792598     -0.21666652380979      6.54182389316268
  C   -9.55680016315516      1.03365217654061      6.92941082608242
  O   -10.03779084107571      2.15772927530517      6.76343724527789
  N   -8.33142877878875      0.79503634403032      7.50084299181161
  C   -7.43318069511674      1.72125628221342      8.04526792034595
  C   -6.25338605308401      1.21451827284412      8.61974365554692
  C   -5.32790559083364      2.07075648808262      9.20572299645704
  C   -5.58419190600824      3.43593253926908      9.23307920334705
  F   -4.63858744850937      4.25131286215386      9.77156828948928
  C   -6.73705857352468      3.97974497364418      8.65714545027659
  C   -6.98560906854864      5.45986413369050      8.65327785674427
  O   -6.75960281128071      6.15218424423452      9.63494346052945
  C   -7.48131971029964      6.06949666909665      7.33650476800161
  C   -6.64877365855446      5.56540345488271      6.18482912812559
  C   -7.23033925493346      4.96062823808119      5.05846902290047
  C   -6.41551553854036      4.29359551160550      4.14590495099265
  N   -5.08755040206251      4.24051707411536      4.28748307135129
  C   -4.50251042730953      4.88615030885933      5.35008105831436
  C   -5.25785039056427      5.57237133889528      6.31080932170424
  C   -7.65222371025625      3.10630062541038      8.05002344507612
  C   -2.69474458970891     -4.85019834919582      7.60684189573275
  C   -2.88298166467808     -4.29146022470900      6.21292204872858
  O   -3.71114144369589     -3.41283709557778      5.97067693623899
  N   -2.07184652453261     -4.84931651365554      5.25292888490392
  C   -1.99938266536928     -4.55091452310914      3.87710947442751
  C   -0.83028266007530     -4.93752067098499      3.19724829891114
  C   -0.69574798867644     -4.70437358722884      1.83435511634017
  C   -1.72490497580777     -4.06543848191883      1.15301777873425
  F   -1.57006963445638     -3.88616248820693     -0.18716649506962
  C   -2.90435269701480     -3.66598585811044      1.79060246279060
  C   -4.07649029513329     -3.03547528851242      1.08956206136995
  O   -5.21474751039232     -3.32000748668347      1.43816633833353
  C   -3.82667150303289     -1.95201818650901      0.03896068896699
  C   -3.84588750578475     -0.63672091712311      0.78487314797745
  C   -5.02062315160815      0.13612669910517      0.82559169138681
  C   -5.06500730956921      1.26292847135423      1.64327271485993
  N   -4.02693597782268      1.62269162133239      2.40113104854376
  C   -2.87087821556887      0.87261597495092      2.37885934371696
  C   -2.73811472581339     -0.24731273287826      1.54305373494529
  C   -3.03092742806806     -3.93034309936564      3.16585517370147
  C   -5.60369639192129     -6.18333158931709     13.25598651512808
  C   -5.62874045254550     -6.56802819518396     11.79103778885458
  O   -5.26782112907289     -7.67789762882682     11.40276684388829
  N   -6.08746720253852     -5.57734099409444     10.94868867793820
  C   -6.22996752797688     -5.60461821202699      9.55097263395813
  C   -6.05727586902026     -6.76823613348429      8.77671500511181
  C   -6.22269207003602     -6.70331810579042      7.39570570325353
  C   -6.54405419195339     -5.49832702058104      6.78369261447606
  F   -6.70938147129788     -5.50774270989522      5.43772049278434
  C   -6.72027602119179     -4.31794049050956      7.52096499478061
  C   -7.02660159348804     -2.96428947710605      6.95548620738174
  O   -7.40932530958867     -2.07548570331040      7.71827584821988
  C   -6.82445675977187     -2.72091021716785      5.47434164448128
  C   -6.67485424178854     -1.27013458929596      5.11096385990353
  C   -7.65960583558861     -0.58831401537478      4.38784634169910
  C   -7.41800463720229      0.75047812223346      4.07913240248099
  N   -6.31034134395233      1.41336742362359      4.40462101078905
  C   -5.33432993751465      0.76489518906495      5.09483178616637
  C   -5.51479309317747     -0.59175396728938      5.47576066348800
  C   -6.56554963394651     -4.40840287447590      8.91182636038118
  H   -9.72368124484429     -1.13383037911141      6.61823706638298
  H   -11.19603744922154     -0.30200449959549      7.20122830709740
  H   -10.68757184218143     -0.10118399150693      5.51445968566994
  H   -8.01385834436312     -0.18034628290784      7.51055858558620
  H   -6.06363774688798      0.13993850994697      8.59101850649257
  H   -4.40214308433994      1.69159921787122      9.63983817251188
  H   -7.42233272863706      7.16108678582474      7.45366495135747
  H   -8.53985338934051      5.80494212835411      7.18479566378445
  H   -8.31228842817007      4.94749929429560      4.92874876383965
  H   -6.83700150787240      3.75650193240680      3.29800351378783
  H   -4.76735007392351      6.00584101042903      7.18380715254483
  H   -8.55340101482573      3.49134845595621      7.58125701371479
  H   -1.83734495528341     -5.52860769984091      7.70414584295315
  H   -2.57820542699043     -4.01193485804732      8.30599631941413
  H   -3.60814963645939     -5.39190175147891      7.89207631718518
  H   -1.37662514152697     -5.51088534356956      5.58618812819425
  H   -0.02193054015508     -5.42951193140749      3.74273766734752
  H   0.19512806553224     -5.01788312354370      1.29009525142958
  H   -2.86831736656654     -2.09757143504376     -0.47114367483151
  H   -4.64581388272394     -1.99170997253499     -0.69024405073753
  H   -5.89468843233964     -0.14874808111674      0.24181764529941
  H   -5.95543955201877      1.88775881643131      1.70891709997267
  H   -1.81799891577200     -0.83289140671053      1.54893454010354
  H   -3.94743112358585     -3.63122250922201      3.66683231142187
  H   -6.25996234611003     -6.87034971160104     13.80791237152038
  H   -4.58397256056611     -6.32768990899692     13.63755577659501
  H   -5.92042092960288     -5.15108982055427     13.45308633741392
  H   -6.33087797497416     -4.69343435534157     11.38683184445661
  H   -5.79662083737348     -7.70423527765001      9.26315125386027
  H   -6.10816350031875     -7.59514692533130      6.77889768181235
  H   -7.68007267425187     -3.17752579728788      4.94724516366427
  H   -5.93794618766173     -3.28548963704875      5.15500582397341
  H   -8.58044524857624     -1.08100388894977      4.07439438654569
  H   -8.17228408616032      1.32721928199728      3.52956716090697
  H   -4.73202360831995     -1.14085748217190      5.99693152784829
  H   -6.70709498868929     -3.48994937299707      9.48599230656081
  N   -2.24670499892355      4.03021068496683      2.79458285567904
  N   -1.63013933990575      4.61436626511652      2.03642729153421
