121
Coordinates from ORCA-job /scratch/magstr/orcajob__5655497-0MDY/orca
  N   -3.17787336672924     -3.30191384561694      2.37652344329948
  C   -3.55481107284920     -3.88294583799282      1.07407398103017
  C   -3.21435689101259     -5.35500292857237      1.06957123741512
  N   -3.83511008704549     -5.96321875322096      2.26224641388591
  C   -5.25690587658046     -6.29116399778857      2.04372659889526
  C   -5.99069500435435     -6.14328688521098      3.35854013784749
  N   -5.71111408668529     -4.81828647092367      3.94393493159509
  Mo  -3.81033303535178     -4.27736098246970      3.98511898516366
  N   -2.62594958343472     -5.69394453331359      4.69282761246650
  C   -1.97913577913773     -6.54534636932956      3.68055600975391
  C   -3.05280202606600     -7.10784549495055      2.77268124808106
  H   -1.41670399159521     -7.36462327111801      4.14436090854933
  H   -1.24815554240194     -5.96074821687368      3.09498475400468
  H   -3.71997963817926     -7.75447107926124      3.35883753441594
  H   -2.63614439640813     -7.69964629987983      1.93987169063526
  H   -7.06503062130595     -6.26874821566699      3.17248654964947
  H   -5.69790176674016     -6.94071489888056      4.06390135246530
  H   -5.66967731024744     -5.57472622445717      1.32099641380485
  H   -5.36661771879120     -7.30577198720170      1.62398702382545
  H   -3.01889534814000     -3.39125601726801      0.25309064158153
  H   -4.63077392978963     -3.72976598510976      0.87912292323443
  H   -2.12530506188986     -5.47356786333672      1.14437783337856
  H   -3.55534228007331     -5.85810838225282      0.14853858068767
  C   -3.46241669772501     -1.01720072750335      1.43789361902636
  C   -2.53067156628382     -1.95007335670811      2.23362878890614
  C   -2.24359127592178     -1.27957206836029      3.57516911024583
  C   -1.18389657726843     -2.12430289284336      1.47737807685885
  C   -0.14880220270869     -2.99601019091586      2.18568203159940
  C   1.02449140736791     -3.43115432370113      1.30179209110542
  C   0.63863985876298     -4.48319684612727      0.25627262748661
  C   1.78783070934508     -4.73110460417363     -0.74246540458889
  C   3.17290171218514     -4.54113066504207     -0.09088246220060
  C   3.12701916353239     -4.91835716312832      1.39063130075852
  C   2.18143035443842     -3.97930835459946      2.16678452353606
  C   -6.62870723526633     -2.90673071648073      5.32654911497175
  C   -6.93866771960786     -4.16972291589357      4.52697101031775
  C   -7.63934600841613     -5.15236622579010      5.48416873358367
  C   -7.89205344067353     -3.79405144469698      3.35902795961988
  C   -7.34371104134606     -2.73944157988401      2.39536230203845
  C   -8.09077879477906     -2.63111787385668      1.05672959738576
  C   -9.59535608069265     -2.38221703547273      1.21323731530562
  C   -10.23682034070908     -2.00021964987286     -0.13644569350039
  C   -9.55088450391403     -2.70408314383603     -1.32743905908366
  C   -8.97039990993764     -4.05222629866231     -0.89763631463968
  C   -7.84951351012235     -3.85393418455616      0.14094778510676
  C   -2.97178211153906     -5.16244279491872      7.12857710116240
  C   -2.24099891816359     -6.03124207772844      6.10460254401714
  C   -2.67317546948795     -7.48795972057257      6.37807562771621
  C   -0.71183783506370     -5.89555603910844      6.30566420115876
  C   -0.13887834652791     -4.49275956521135      6.10394646081672
  C   1.39326537366680     -4.42814867663123      6.13659571017431
  C   1.98856733090981     -4.92280942092074      7.46255601404508
  C   3.51735850689200     -4.82420318685295      7.47957518091743
  C   3.99695850585582     -3.40466613477609      7.16747794516412
  C   3.41008388446344     -2.90374229161869      5.84549778489458
  C   1.88341862866353     -3.00312251896000      5.84510536137226
  H   -4.43798164639768     -0.93811908245938      1.93908590098434
  H   -3.62749953665104     -1.36108046575685      0.40842544135070
  H   -3.01994323023489     -0.01306707922403      1.38494583713754
  H   -1.65810109495356     -0.36937777564835      3.38551724028766
  H   -1.66496464017100     -1.92106800946029      4.25104756117133
  H   -3.17300245011425     -0.98239174976619      4.07664073238183
  H   -1.37468190096979     -2.51736733395116      0.46788969325074
  H   -0.77411892625224     -1.11310769340135      1.32352318779803
  H   -0.63849647799012     -3.90258607509549      2.58371703446446
  H   0.24677168186805     -2.45897371902122      3.06225959896353
  H   1.38921500423379     -2.53895341819558      0.75964120760865
  H   -0.27169778306940     -4.19134251073759     -0.29035115803994
  H   0.39095404537937     -5.41970586914868      0.78935289353052
  H   1.70233613453769     -5.75164704652172     -1.14758698182535
  H   1.68713774040927     -4.04820452944442     -1.60036910512917
  H   3.49076401078459     -3.48920606508864     -0.18149298199129
  H   3.92785833888916     -5.13674553390125     -0.62475304463774
  H   2.78046820093418     -5.96174429197099      1.48177431881403
  H   4.13345238369750     -4.89228635717947      1.83406660290897
  H   1.75661612946398     -4.51640717801152      3.03205191227580
  H   2.74708446411315     -3.13087131416438      2.58343205802411
  H   -6.05633510244718     -3.13962988949634      6.23386359805655
  H   -6.07901659486975     -2.16102364601112      4.74102469010730
  H   -7.58244549241314     -2.45733364427671      5.63592545516318
  H   -8.48540783019247     -4.64844945555892      5.97088388218874
  H   -6.94310963322076     -5.48510249977118      6.26785552548229
  H   -8.03604608492983     -6.03820867431000      4.97178879118854
  H   -8.82871359636038     -3.43731635215242      3.81492948637345
  H   -8.16574616832804     -4.70657401743565      2.80686618828686
  H   -7.36482073588467     -1.75216495861421      2.88408655783546
  H   -6.28129822084358     -2.95795684523183      2.18961653157290
  H   -7.67321650419187     -1.74621279592322      0.54369882310640
  H   -9.77776784990282     -1.59091858295287      1.95776083438425
  H   -10.07292841969008     -3.29351179371958      1.61040757659496
  H   -10.18529909727067     -0.90929283647524     -0.27666171847027
  H   -11.30671078577666     -2.25897965403219     -0.11511120027107
  H   -10.26325734393058     -2.83084443028343     -2.15568750827005
  H   -8.73373717884433     -2.07487922999339     -1.71846493483309
  H   -9.77730903244237     -4.66640026860258     -0.46404734885979
  H   -8.58968802702966     -4.61310661207587     -1.76435253740551
  H   -6.88184550867708     -3.72514752006284     -0.37357236405029
  H   -7.75692993097231     -4.76777652985544      0.75089971228938
  H   -2.72833725523606     -5.53406721197002      8.13341486998920
  H   -2.66910084749778     -4.11223179719156      7.07768798484258
  H   -4.06148512241884     -5.22149214181935      6.99799630045223
  H   -2.16086134092958     -8.21855158965916      5.73868100097677
  H   -2.43631662738804     -7.74706508591670      7.41912473145142
  H   -3.75794038715289     -7.59462699014828      6.23489046953494
  H   -0.49523377592305     -6.24963770397377      7.32520989454871
  H   -0.19316530018355     -6.59800691427523      5.63220135213956
  H   -0.53063280171074     -3.80994424329918      6.87711817508070
  H   -0.48541675054925     -4.09291281767259      5.13526240292732
  H   1.77699943342524     -5.08652648471886      5.33145997538684
  H   1.57172106270619     -4.31065345590962      8.28440747410923
  H   1.68279205705031     -5.96211017118150      7.65846201055400
  H   3.90578500272755     -5.15481185151224      8.45539500007639
  H   3.93057310323433     -5.51859453716946      6.72636493029343
  H   5.09703075600053     -3.37007573327109      7.13722738193342
  H   3.68229306584360     -2.72767527867240      7.98162714281195
  H   3.72427379110706     -1.86562201976364      5.65415065801041
  H   3.81080880575731     -3.51223083066380      5.01506555174469
  H   1.47878765548998     -2.65888328322794      4.87965943784408
  H   1.47322674983961     -2.32562728136153      6.61684577720303
  N   -3.77283444911184     -3.07065656156661      5.21605029396894
  H   -3.74061856948785     -2.36415344997070      5.95376740337590
