116
Coordinates from ORCA-job /scratch/magstr/orcajob__5668094-WlTX/orca
  N   -3.17254301268877     -3.54932425220903      2.66026099425014
  C   -2.83070953993049     -4.46445123547639      1.57030577787395
  C   -2.63136942859479     -5.86593832791733      2.10570680031004
  N   -3.82718921689389     -6.23653175611914      2.89880219667938
  C   -4.96820197540164     -6.57195974039830      2.00791070782219
  C   -6.25848933034088     -6.12620556203298      2.65362643810428
  N   -6.17879434390832     -4.72160850995749      3.05872671738017
  Mo  -4.34923092452950     -4.51563110826486      4.15654819403693
  N   -2.82676954986192     -5.40339343506597      5.29124564717397
  C   -2.60219867385003     -6.80999849357759      4.95391194267010
  C   -3.55780321215135     -7.31155882621058      3.87779555377245
  H   -2.72629257598349     -7.48506068858956      5.82473513460988
  H   -1.55939795681908     -6.96702669590274      4.60711583832335
  H   -4.52674931360443     -7.56743221588714      4.32437867700459
  H   -3.14054218247131     -8.19987630009890      3.36740741041583
  H   -7.07351580364319     -6.31315517727145      1.93390576958601
  H   -6.45949600859110     -6.77609846387979      3.52766541518531
  H   -4.82588681255514     -6.03267904311515      1.06239154527623
  H   -4.96481080646117     -7.65505903437094      1.79450568548200
  H   -1.90141111075400     -4.18344077651280      1.04674344069401
  H   -3.61771575331103     -4.47512389274507      0.78524016731253
  H   -1.76132711963250     -5.88577196337793      2.77344854141905
  H   -2.47215808243109     -6.60105438159532      1.29591623415625
  C   -2.75132856715337     -2.16696750921109      2.31539522984644
  C   -1.23296542884200     -2.07913678514436      1.96730825417748
  C   -0.28510802935192     -2.87547678018354      2.85463848468088
  C   1.16027554188706     -2.78997641429699      2.35820550672270
  C   2.09200055269596     -3.84799602085509      2.91896592216810
  Cl  1.64829434340948     -5.51190865211346      2.33586057956303
  C   -3.05242363696364     -1.22399122002265      3.49254034771805
  C   -2.87331004954949      0.26806818401985      3.19366818208823
  C   -3.68433450025900      0.69588353133439      1.96862500151210
  C   -3.34290205018344     -0.17508724468779      0.75850549133313
  C   -3.53654033126387     -1.66256993034297      1.07030035607987
  C   -7.54792814623872     -4.15024897565959      3.12278654521151
  C   -8.55919278047488     -5.05230344734266      3.94639486945709
  C   -7.92743201459547     -5.80072821504127      5.07742179496197
  C   -8.14454225566048     -7.25673477199560      5.31283871251365
  C   -9.12814632398573     -7.44592767385051      6.46166558682197
  Cl  -9.35847175958672     -9.21871071195092      6.88705336563295
  C   -7.57831843125606     -2.72318046032632      3.71265430590607
  C   -6.78196072552701     -1.71329614459786      2.89551572276997
  C   -7.32291865490451     -1.61868977910036      1.46893847042115
  C   -7.36825258744129     -3.00518163972343      0.82327534702682
  C   -8.14271354666774     -3.99790039217492      1.68981763862150
  C   -2.18245605044366     -5.01934165004840      6.58913752383264
  C   -3.11568894311850     -5.42982351527006      7.75856523838541
  C   -2.68866067540809     -5.08819061967678      9.18704057899872
  C   -3.73010838744198     -5.54559475307611     10.20810431132309
  C   -3.40281262438684     -5.18693372222111     11.64449648123822
  Cl  -1.90465406190530     -6.02587259748251     12.23691863812553
  C   -0.79755797529690     -5.70084237952851      6.76930972215987
  C   0.26401664131397     -5.02579909591293      5.90606320514003
  C   0.59703650153252     -3.63834023643446      6.48653817721497
  C   -0.61412732061134     -3.04370432880780      7.22791797381119
  C   -1.94364109136544     -3.48081087438057      6.60511846104913
  H   -1.08246379916814     -2.40148195179670      0.92292267292479
  H   -0.93261079595147     -1.02033157721644      1.97470447914915
  H   -0.60261820720983     -3.92692237878510      2.87330705446798
  H   -0.34150641377636     -2.52369250937924      3.89634865100542
  H   1.18215012149338     -2.85370014240646      1.25755259950502
  H   1.59365084732101     -1.80752433717738      2.61835899880363
  H   2.05738723188830     -3.90186158873563      4.01319068184675
  H   3.12776119031431     -3.69391779909940      2.59524674604059
  H   -4.10123039503129     -1.38448026747048      3.77152099036760
  H   -2.43342974880897     -1.51566501538083      4.35644537722061
  H   -1.80856673169146      0.50481397413613      3.02922944771383
  H   -3.18019753130553      0.85167800489758      4.07682340735527
  H   -3.50739585508743      1.75952666480780      1.74329364260519
  H   -4.76116150932556      0.59518245527059      2.19332760523161
  H   -2.30095012250548      0.01642628533703      0.45064669792622
  H   -3.97312902476492      0.10390748942988     -0.10160819957058
  H   -3.24615429799390     -2.26579180505182      0.19648927230702
  H   -4.60447276809657     -1.85711008092131      1.24137031785786
  H   -9.39328869539811     -4.39157456017183      4.25881749905714
  H   -9.02521651537361     -5.79064262502517      3.27059626473156
  H   -6.92132307425933     -4.19644919671355      5.61595559775003
  H   -5.14723699522852     -5.99738864938243      6.40102170481346
  H   -7.18597802688068     -7.73888778087856      5.57876982306287
  H   -8.53644516585651     -7.75490519030395      4.41212628268718
  H   -10.12791598704884     -7.07110626054634      6.21402943465120
  H   -8.76719640875252     -6.96494319631543      7.37772069780646
  H   -7.26001527042677     -2.71431020053941      4.76660258630034
  H   -8.63630449968615     -2.41226861260293      3.74100670138587
  H   -6.79756568341941     -0.72378405030683      3.38271390555311
  H   -5.73423464234900     -2.04680822291521      2.85812522564053
  H   -6.70657083467204     -0.93041715788626      0.86849140475051
  H   -8.34147605748098     -1.19137788757484      1.49435740680082
  H   -6.33885514208825     -3.37884259467300      0.69388299497610
  H   -7.82044579133296     -2.94724772075767     -0.17965350614103
  H   -8.18945915453022     -4.97874125231244      1.19443886674123
  H   -9.18985257408457     -3.66124387201138      1.79482834887067
  H   -4.08939842584190     -4.94816418642979      7.57131406218935
  H   -3.29066459633095     -6.51882113056033      7.69427530541837
  H   -1.72479361725152     -5.55681206127639      9.43538031786291
  H   -2.54389105563078     -3.99919603642447      9.29128219838482
  H   -3.88508970463450     -6.63394721771235     10.12948293423189
  H   -4.70445750919379     -5.07572452032241      9.97976013377244
  H   -3.20735082450237     -4.11346423986160     11.76458242745768
  H   -4.20021119715758     -5.48886955444121     12.33331701416632
  H   -0.86370311153466     -6.77640403861471      6.56914666062092
  H   -0.50265758048311     -5.61783701660837      7.82611127681542
  H   -0.13202822084667     -4.92629417320019      4.88337676955957
  H   1.17037089072327     -5.64488541136835      5.83071340175565
  H   1.44646121675700     -3.71586394547784      7.18360644578885
  H   0.91854420882781     -2.95494455087360      5.68565976210963
  H   -0.55541280805503     -1.94395470248975      7.23472608019180
  H   -0.58970045933938     -3.35306067532232      8.28385311025047
  H   -2.75955217356245     -2.98706625214663      7.15664674146877
  H   -1.98185628336084     -3.13853607959502      5.55935537918144
  N   -4.81567199524551     -2.78888783696905      5.58199388347985
  H   -3.97108659994093     -2.25986169810935      5.80791310154522
  H   -5.15357001136006     -3.20360361691423      6.45735287578826
  H   -5.51350125721103     -2.10825544495310      5.27061556295747
  N   -5.52844756893134     -5.66262317557737      5.51712742247847
  N   -6.88711888386948     -5.20266311760725      5.77474659427372
