120
Coordinates from ORCA-job /scratch/magstr/orcajob__5655486-i1U5/orca
  N   -3.04897606962994     -3.48759233972239      2.40985271302486
  C   -2.71640375126867     -4.42052846953960      1.32414274564101
  C   -2.62774034913096     -5.83519513496810      1.86318047877251
  N   -3.75796971322006     -6.09207538144285      2.79890379407648
  C   -5.03444272971579     -6.34747589239210      2.07133975526027
  C   -6.21308934512952     -5.95744044694218      2.94772449763330
  N   -5.92372775277889     -4.66743182721100      3.59323464598154
  Mo  -4.05294901479100     -4.24985052024966      3.96328264219840
  N   -3.26574675770723     -5.38592230660473      5.40487332324211
  C   -2.57653192894442     -6.57922304506551      4.88475768172735
  C   -3.41492678032350     -7.18358914732379      3.76165953582806
  H   -2.43362218274515     -7.33563010028996      5.67808232332572
  H   -1.56676557855541     -6.32289100278929      4.51719188038796
  H   -4.35463635369217     -7.57123032789371      4.18041758794428
  H   -2.89950776201647     -8.00492046613916      3.23174542543419
  H   -7.10872121952494     -5.89734284663394      2.30871535302314
  H   -6.41108905563854     -6.73724082128003      3.71096139205923
  H   -5.03346731237023     -5.71481075537836      1.16988529913577
  H   -5.08613357651406     -7.40509945749590      1.75423082900700
  H   -1.73604809296838     -4.16652523324354      0.88528838141987
  H   -3.45771867393975     -4.34711109296688      0.50330129821476
  H   -1.69852060119525     -5.93565647499762      2.44024057451910
  H   -2.62048195453772     -6.58971234966337      1.05670629342808
  C   -3.85831090114731     -1.12920719933132      2.00564873817328
  C   -2.67391387996378     -2.09842767439010      2.06694332669970
  C   -1.52328458404797     -1.58069347241915      2.96718457109999
  C   -0.32867310458023     -2.49025751412383      2.87621658501225
  C   -0.18018888007501     -3.57852632465024      3.74992177631750
  C   0.84750655916193     -4.50591193417415      3.58410358228549
  C   1.74864496058844     -4.35362890374067      2.53498016445695
  S   2.97196079869034     -5.60962514723470      2.26491806669432
  C   4.51794193119699     -4.76970959582371      2.54040805101453
  C   5.66328970070911     -5.35455326844589      1.97818400097416
  C   6.91492622343221     -4.80067595322290      2.21910975484845
  C   7.03633464220480     -3.65835821081208      3.00645695278199
  C   5.89246192680541     -3.07634630419677      3.56011537244181
  C   4.63524887315806     -3.62858931708193      3.33728384937291
  C   1.62596043926880     -3.25583975268704      1.66441247118791
  C   0.60035419955131     -2.33306471171989      1.84174429961020
  C   -8.20690310015057     -4.67798451926077      4.61414747739017
  C   -7.07523709717548     -3.84667129927575      4.00586697302542
  C   -7.55203673833443     -2.89436630295880      2.86736460490390
  C   -7.89033539895106     -3.57960413343638      1.57214943860483
  C   -6.92565049654841     -3.71243230969789      0.56349283271705
  C   -7.18643543420187     -4.43241102553520     -0.60571941594634
  C   -8.44267837764671     -5.02271770156052     -0.80281910474213
  S   -8.74192128480152     -5.86080032797816     -2.33997373248499
  C   -9.82138042516020     -7.19984353202674     -1.84646572295160
  C   -10.94164693764479     -7.47078134436739     -2.63935281770427
  C   -11.76098455365737     -8.56052629572874     -2.32713533841129
  C   -11.48149371802979     -9.36846981755097     -1.21705330884213
  C   -10.36447377495752     -9.09165805596871     -0.42296576349701
  C   -9.52832863569103     -8.02147158679981     -0.74094227578926
  C   -9.43397017502484     -4.85900411395231      0.17818608843661
  C   -9.15350943758768     -4.15142608854567      1.34758852571163
  C   -5.07212066096958     -5.39947410706151      7.13176804936822
  C   -3.56534119063051     -5.40704225723226      6.85574324733274
  C   -2.86313613380258     -4.30030017766896      7.66948875041654
  C   -1.37613632509887     -4.17308271302531      7.45493616473623
  C   -0.53037608945311     -5.28985701671732      7.48161010711971
  C   0.85004472069733     -5.16981651895258      7.33325271945578
  C   1.43088017554881     -3.91037806032308      7.15090893374168
  S   3.17417008759320     -3.65159918970971      6.96598732373781
  C   3.86898091248477     -5.32127869104949      7.07396958536860
  C   4.32070730075074     -5.82943020467682      8.33796354045336
  C   4.87982390613178     -7.14190914275742      8.43015530932766
  C   4.98162340260637     -7.93982847712031      7.28432964854238
  C   4.53453939611969     -7.43454812947059      6.02291415703238
  C   3.97808499406298     -6.12502339307322      5.92062484480371
  C   0.59801778509986     -2.78248150599785      7.11976538678243
  C   -0.77928057959844     -2.92247008116382      7.27201161504195
  H   -4.34033160669794     -0.97293682891723      2.98615958448709
  H   -3.53112939200499     -0.13855971926958      1.64393766290190
  H   -4.62462469715824     -1.50953282335317      1.31425674714768
  H   -2.25987741171171     -2.13130638220447      1.03996458657834
  H   -1.87366378108667     -1.51617596252832      4.00884596880234
  H   -1.26456983556002     -0.55824144621566      2.64652468108865
  H   -0.86965628835705     -3.68159513591673      4.58160527435650
  H   0.96657379635740     -5.33908553852010      4.28382235895325
  H   5.57004833133727     -6.23898247226958      1.34814824440238
  H   7.80120909736237     -5.26143989311929      1.77591729623898
  H   8.01796745320700     -3.22295959647768      3.18726620841299
  H   5.97559832980321     -2.18597494475725      4.18280213142577
  H   3.75066318866697     -3.18059086032546      3.79255507342993
  H   2.33489581898999     -3.13276377392629      0.85397411675274
  H   0.50620536937252     -1.48471924045665      1.15415498985680
  H   -8.98063933140731     -4.00836553846725      5.01766561459235
  H   -7.83095177953551     -5.30392120730802      5.43792061725868
  H   -8.68497707544308     -5.33343243158335      3.87209962251736
  H   -6.71260563540687     -3.17770428102449      4.80583493998271
  H   -6.74930184652278     -2.16393302423527      2.68784284688586
  H   -8.42430973236096     -2.33561312267217      3.24614198987829
  H   -5.93892055736388     -3.26975335280980      0.71182248794411
  H   -6.41242818504859     -4.54145978002400     -1.36731718502799
  H   -11.17149685066677     -6.82149016184268     -3.49187132463333
  H   -12.63272320834048     -8.76744071078871     -2.94997392596340
  H   -12.13039155998264    -10.21458225622182     -0.96874774848419
  H   -10.13654829178168     -9.72696250659160      0.44349223145388
  H   -8.64616259098927     -7.81588649435081     -0.13177567454305
  H   -10.42430604241781     -5.28623246830910      0.02215889723173
  H   -9.93788178697711     -4.03240284639139      2.09778597256991
  H   -5.56558875093579     -6.23019890259591      6.61120931557097
  H   -5.54286962537957     -4.46757956007034      6.78592031050163
  H   -5.27138792026921     -5.49493435985263      8.20774301197898
  H   -3.18251167814455     -6.36937349985725      7.23971947792751
  H   -3.06712297906444     -4.51400485346352      8.73803123693586
  H   -3.34233832909442     -3.32616353081994      7.48059546131247
  H   -0.94996195305480     -6.28207689269052      7.63906224687295
  H   1.47833847353893     -6.05873775606562      7.36451120930021
  H   4.23589287044635     -5.19474531843298      9.23649539792212
  H   5.22387650528251     -7.51991841821454      9.40604719588787
  H   5.40920667287338     -8.93662787732307      7.36882441941973
  H   4.61837415622180     -8.04451411174661      5.12331892106524
  H   3.63878752701606     -5.73870777883618      4.95090982243883
  H   1.03013674009461     -1.79392546338506      6.98151581689512
  H   -1.40509785709098     -2.02683106955583      7.26297725939243
  N   -4.21068061033346     -2.37137315018860      5.25389884765890
  H   -4.49027318648538     -1.53074522438146      4.73924518319781
  H   -3.29929104911030     -2.16423947403668      5.67378037008970
  H   -4.87130736937992     -2.46745111267249      6.03168535119474
