129
Coordinates from ORCA-job /scratch/magstr/orcajob__5661788-6qHt/orca
  N   -3.17347739627771     -3.54937828267740      2.05735490577870
  C   -2.48917843389978     -4.53167120985390      1.20022900848488
  C   -1.99912969481899     -5.70645116235720      2.02260026357365
  N   -3.05207109295790     -6.13158614343422      2.96845683396557
  C   -4.19616478013859     -6.79013433629284      2.29888824684228
  C   -5.41871741639455     -6.70791838089226      3.19231087195730
  N   -5.62364272414888     -5.31116066894393      3.59421793007577
  Mo  -3.89359628570632     -4.27671049468039      3.82461774557590
  N   -2.66197212932709     -4.84084111996666      5.33463767745555
  C   -2.90943682483307     -6.28656967309435      5.41983624200966
  C   -2.52073147331633     -6.95274994467322      4.09659379883125
  H   -3.97245528764975     -6.49765401129588      5.63682759551366
  H   -2.34423318636061     -6.76364065285002      6.24057090439262
  H   -2.90553781692033     -7.98397495125278      4.02796253840021
  H   -1.42636472651534     -6.99809508409202      4.00330392863163
  H   -6.26457122891041     -7.11754499126663      2.61594124079764
  H   -5.28932209548422     -7.38775498474957      4.06236644860584
  H   -4.40408512024783     -6.24077045522589      1.36990432894062
  H   -3.95079185191160     -7.83767770363733      2.03980489036721
  H   -1.60321021983165     -4.10363999874825      0.69830479278938
  H   -3.14876028153810     -4.88973133330324      0.37922250602215
  H   -1.14856519324399     -5.38582746191800      2.64018774879037
  H   -1.66661976391486     -6.53614950240881      1.36671203761851
  C   1.24907758116796      1.42775958556701      1.80868006511331
  C   0.15975559894805      2.28645013282440      2.44868737834010
  C   -0.43561388051451      1.67350016524849      3.70699431136389
  O   -1.01682494826342      0.37135647507693      3.45233698122728
  C   -2.32334517425710      0.37407599618310      3.04730054058657
  O   -2.99467311111191      1.38073430940676      2.85285725579847
  N   -2.76550897210161     -0.91157093904932      2.93476418243235
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  C   -3.69516926762104     -2.40879341747174      1.24040736265674
  C   -5.02492099254549     -2.79432796622074      0.52406199365406
  C   -5.17810410487753     -2.22479463563781     -0.89352734369146
  C   -4.69439415932935     -0.77546504564925     -0.96313437270223
  C   -3.19728219525038     -0.66923850320880     -0.58590088090963
  C   -2.69272053763102     -1.91029775990329      0.17134400896650
  C   -10.83619842696158     -1.16276177468949     10.25767667177110
  C   -10.59384172367147     -2.42817778371171      9.43579898310596
  C   -9.25932316199967     -2.37333844138376      8.71883073724210
  O   -9.11662656134095     -3.59622758687415      7.95526313607760
  C   -7.96084841865804     -3.69850107867013      7.23682557506384
  O   -7.07580750120476     -2.84294054564664      7.23166287038296
  N   -7.93632799187478     -4.86327300945210      6.54162338368737
  C   -6.81303984984099     -5.24991526411799      5.70718329369910
  C   -6.96461064119306     -5.01545653578515      4.17418596166069
  C   -8.10501754710257     -5.93621549887851      3.68364570183916
  C   -8.47123329750565     -5.81356563933397      2.19533309463938
  C   -8.33871209490690     -4.36796124468945      1.68250652391762
  C   -8.49780596901157     -3.38194019143726      2.83697640031693
  C   -7.36140415588139     -3.54417841663637      3.85512452396648
  C   -3.66932728159875      3.75719858139214      7.06318208746536
  C   -3.68831727624732      2.39438973071466      6.37315776713717
  C   -2.62727477291601      1.47057096458502      6.93965388349362
  O   -2.70184346527988      0.22599221697452      6.20966800918739
  C   -1.80606537319020     -0.73783314092714      6.58494030593118
  O   -1.00613081334285     -0.61646124885615      7.50544996714970
  N   -1.97777925430372     -1.83516456187187      5.79362337067354
  C   -1.07619049405238     -2.96603522068258      5.81916502788373
  C   -1.65448436040227     -4.32299416665308      6.28843663753707
  C   -2.29589856978853     -4.18872552599613      7.68852604880367
  C   -1.31931710348480     -3.84683898997256      8.82416228174572
  C   -0.03515801893287     -4.71333230528152      8.79424729646441
  C   -0.13359210345712     -5.83936612086150      7.76298886239819
  C   -0.39428521664524     -5.26220292612586      6.37030053710602
  H   2.08115513117999      1.25571793902417      2.50875700438958
  H   1.65779525243174      1.91126963007417      0.91034332962714
  H   0.85372844947231      0.44579948854172      1.51216738484881
  H   -0.65289844844769      2.47851345770452      1.73092808115028
  H   0.56834278820645      3.27172839218486      2.72986001922157
  H   -1.20567831040066      2.32746751604998      4.13786144786352
  H   0.34162392441875      1.47828540128109      4.46009773901081
  H   -2.06710068235629     -1.65716434147801      2.92491407228987
  H   -4.35047301210844     -0.36708382792958      1.70279788458211
  H   -4.76549246528120     -1.59881688475492      2.91070557926712
  H   -5.09893921644176     -3.89192194268315      0.49849595181892
  H   -5.86471207063011     -2.45218125505435      1.15138699332728
  H   -6.23050196445498     -2.29788975416935     -1.21024010394933
  H   -4.60049656935434     -2.83653538200686     -1.60701575880885
  H   -4.86632512191576     -0.35856816241518     -1.96670454443896
  H   -5.30374520027858     -0.16923960854209     -0.27240829121595
  H   -3.02538945753941      0.23725844280568      0.01421706821923
  H   -2.58737247721960     -0.55282214485113     -1.49534741940528
  H   -2.51791538281712     -2.71423802724846     -0.55687514216806
  H   -1.71605156562249     -1.69773625193515      0.63449462943259
  H   -10.83844872366031     -0.26665992954830      9.61903068774093
  H   -10.05632885460107     -1.02627631751877     11.02194545110307
  H   -11.80510582343378     -1.20891892431025     10.77315541304317
  H   -11.39604616067278     -2.55732850364155      8.69192430394773
  H   -10.61608414554012     -3.31577198885728     10.08784833836187
  H   -8.42166066551118     -2.29217409330025      9.42874062151670
  H   -9.20456267777478     -1.51328880186582      8.03319376233835
  H   -8.73658905886473     -5.47862889378236      6.64122014674287
  H   -6.61303967785215     -6.32083428884024      5.87101300914115
  H   -5.93182489636334     -4.69982498687382      6.05888364934429
  H   -7.89139663554680     -6.98481967889017      3.94293474366035
  H   -8.99078087805646     -5.65979722416452      4.28014164587354
  H   -9.50803349464318     -6.16399323474318      2.06737317024377
  H   -7.84718048684932     -6.48231606668333      1.58307575076165
  H   -7.34446364520239     -4.22357181487996      1.23381850487653
  H   -9.07653094845915     -4.17282560683092      0.88940585585908
  H   -9.47668085302812     -3.53876287633976      3.32314881438260
  H   -8.50237230043199     -2.34432612762295      2.46734405892288
  H   -7.63039042741703     -3.00732246727046      4.77649347434556
  H   -6.45797985581576     -3.06146672572503      3.45566786642058
  H   -4.44259923971327      4.41811428975417      6.64826926796527
  H   -2.69740499711452      4.25727242142595      6.93309921563041
  H   -3.85374310058091      3.66271942268057      8.14421203574085
  H   -4.67544589420821      1.91987740129301      6.49362406627980
  H   -3.52219299622445      2.50753165816655      5.29022541918321
  H   -2.78683029032720      1.27371916799981      8.01152662352741
  H   -1.61793829694384      1.89729348340834      6.82298361616726
  H   -4.07107422006028     -2.53979914727887      5.96395542537307
  H   -0.24727708085123     -2.69500368069123      6.48690369316213
  H   -0.66315275383643     -3.11611059296382      4.80704130101354
  H   -3.08923171358661     -3.42656165200262      7.64234498299138
  H   -2.80506176218008     -5.14126143264382      7.90569919069001
  H   -1.05392657132035     -2.78154441191114      8.76623817123999
  H   -1.84620697607082     -3.98138291702328      9.78150526939291
  H   0.17674020869377     -5.12599708288090      9.79207563941690
  H   0.83168844389193     -4.08436684914717      8.53094707345884
  H   -0.93974185889944     -6.53796712952997      8.04546731551793
  H   0.79671817001305     -6.42923775118196      7.74957708687768
  H   -0.47927381420078     -6.06540479352890      5.62845060609289
  H   0.49758410805718     -4.68508010356823      6.07184702417069
  N   -4.72644199565077     -2.55626024166767      5.17468309543332
  H   -5.64807294322622     -2.71154861565764      5.60334819540265
  H   -4.74909399593272     -1.58747213899543      4.83436993029475
  H   -2.49109092694074     -1.66602349252224      4.92728537202489
