125
Coordinates from ORCA-job /scratch/magstr/orcajob__5655514-KC4l/orca
  N   -3.25004959784755     -3.32266562415364      2.21801281322662
  C   -2.93592245176345     -4.29922706137828      1.17468561884255
  C   -2.66235649225711     -5.66182230006001      1.79703518257862
  N   -3.65015519806668     -5.96223660166029      2.86155111749462
  C   -4.95879380120744     -6.39723121488329      2.31778947951454
  C   -6.06500418239519     -6.10268309365512      3.32349310882353
  N   -5.86655081527091     -4.76775886004667      3.88276887347028
  Mo  -4.02937313473462     -4.01889762337188      3.91829810588597
  N   -2.78791863797691     -4.87685438762950      5.21662233233350
  C   -2.16790636147729     -6.14397818773230      4.81278987877075
  C   -3.11134493747584     -6.89623123753558      3.88116823619640
  H   -1.94632738140657     -6.78803333721380      5.67861236847940
  H   -1.19556051665173     -5.97354449530179      4.31470691051149
  H   -3.96521913666972     -7.27036911129524      4.46313333991328
  H   -2.61291127732738     -7.75746334161668      3.39792198500061
  H   -7.03374674968862     -6.18941639503826      2.79891228356339
  H   -6.07758783031437     -6.87672727443912      4.11718939724568
  H   -5.13840817042243     -5.81027830192991      1.40600544735773
  H   -4.93195437868013     -7.46792526549454      2.04153349493450
  H   -2.03284844163179     -4.01504210454131      0.60786158880047
  H   -3.75691835824176     -4.37385928704606      0.43239129296377
  H   -1.67360740423339     -5.63895083965309      2.27278155906287
  H   -2.66033235151361     -6.46101790940033      1.03282484745433
  C   -3.21461967151047     -1.56313175780226      0.42204347634811
  C   -2.99975637342497     -1.91183627243358      1.89812463274263
  C   -1.60564335956708     -1.43230932664568      2.41038057234796
  C   -0.44635774599281     -2.27788975411274      1.96928040606156
  C   -0.11379913156924     -3.43295188066886      2.69541399802549
  C   0.93150477048008     -4.26065967759123      2.29638854928365
  C   1.69863527835569     -3.95736731629554      1.16272006320659
  C   2.85491652629060     -4.84835432035671      0.76047895073400
  C   3.79081895766880     -5.17964759678238      1.90432583862183
  C   4.34044692583391     -4.15779949254778      2.69346739817424
  C   5.20347797971172     -4.45424303750219      3.74851032227776
  C   5.53195629260534     -5.78187543148893      4.03909997261691
  C   4.98851092819117     -6.80658857443148      3.26335699310152
  C   4.12447561361418     -6.50587985524986      2.20595777374415
  C   1.37739733251743     -2.80151285846189      0.44147918981792
  C   0.31892866925742     -1.97710978962904      0.83521944684973
  C   -7.86749698316233     -4.95212516429768      5.37126115016164
  C   -7.06536225830466     -4.09571091225604      4.38786953241470
  C   -7.94268583494598     -3.56949794855556      3.21960557469750
  C   -9.03282096882703     -2.64055090755563      3.67806281718361
  C   -10.37812956514102     -3.03632138650828      3.70657139580584
  C   -11.37351746222233     -2.17885414421882      4.17271166340203
  C   -11.05729039687515     -0.89109618599449      4.62706195922904
  C   -12.14099161517412      0.03727594229918      5.13403467804608
  C   -12.92519751146994     -0.53688678983849      6.29472123354849
  C   -14.29983010713193     -0.78023361345534      6.19031666539920
  C   -15.01704601301762     -1.32086247583892      7.26185395457373
  C   -14.36468879594061     -1.62561286120705      8.45721698657128
  C   -12.99121863936915     -1.38728828708843      8.57295994323288
  C   -12.27988467580893     -0.85067155677844      7.50049173333728
  C   -9.71474243421893     -0.49365579243162      4.60100342029911
  C   -8.71823382317368     -1.35214747834097      4.13359569012386
  C   -3.21482956383141     -5.45309895873614      7.60304280415240
  C   -2.60427445528211     -4.45449493334113      6.61048008847510
  C   -1.15327083273180     -4.02436671330383      6.98314726196615
  C   -0.05473192967613     -5.05164953161714      6.88052539775532
  C   0.05445403653577     -6.12606818311704      7.77625855672489
  C   1.05604714769944     -7.08798865002419      7.62724887090395
  C   1.99211201904041     -7.00756430858073      6.58890851066312
  C   3.07495132491275     -8.04364771397292      6.43218761935324
  C   4.46234747069844     -7.61916062035407      6.88329474404611
  C   5.56332883553072     -8.42487696112604      6.55472018027073
  C   6.85570318977427     -8.06765720720750      6.93713039566179
  C   7.07190084013947     -6.89109178690029      7.66185524934518
  C   5.98327103082574     -6.08661558121620      8.00149550213732
  C   4.68913622517545     -6.44887949405563      7.61559633247525
  C   1.91248667858942     -5.91251416661629      5.71693356630935
  C   0.91093158965605     -4.95507760923851      5.86696341954167
  H   -4.20811806723897     -1.89186403376298      0.08458767136939
  H   -2.46006121550116     -2.02042392969070     -0.23355586372010
  H   -3.15491835226998     -0.47318808751271      0.28964247942237
  H   -3.73776919598690     -1.32930590936296      2.47223382725898
  H   -1.46190527258008     -0.38625983724304      2.09453174407796
  H   -1.64813382143425     -1.44113283248575      3.51071583598831
  H   -0.69873434340120     -3.67881660038970      3.58408060260082
  H   1.17669304485089     -5.14484557824172      2.88970091426670
  H   3.41841466011058     -4.35476849584749     -0.04842964243944
  H   2.47017546234250     -5.79066543567188      0.33608212714965
  H   4.07534334860112     -3.11906378078864      2.48270358688497
  H   5.61686138648912     -3.64584948711465      4.35468108457044
  H   6.19247682273256     -6.01732767474386      4.87459197137051
  H   5.23176045401282     -7.84655656588905      3.48950912731417
  H   3.69713645498650     -7.31304232914309      1.60538522144119
  H   1.97225389351908     -2.53549619762727     -0.43625235761236
  H   0.09546338470543     -1.07528869105166      0.25960406981795
  H   -7.22314635787355     -5.29772251834649      6.19287548815202
  H   -8.69426424955008     -4.36814886053639      5.79948130701004
  H   -8.30442588956347     -5.83520993552501      4.88036896927419
  H   -6.70939821084554     -3.20434681508959      4.92508947799886
  H   -7.26420610695495     -3.04311165039364      2.53023768280084
  H   -8.38112453156540     -4.41907041297971      2.67166081048438
  H   -10.64602546072917     -4.03665000375012      3.35665352805128
  H   -12.41320771410644     -2.51510317585246      4.19275728414280
  H   -11.67721933228678      0.98952319442297      5.43723453478989
  H   -12.84081691394065      0.27470789024459      4.31651173282138
  H   -14.81423978610103     -0.54186298017856      5.25598979759451
  H   -16.08840269434632     -1.50458594190727      7.16006065748786
  H   -14.92150489366162     -2.04775973591660      9.29556841615093
  H   -12.47284843320751     -1.62276195103512      9.50452429320161
  H   -11.20480655094011     -0.67763408381927      7.59215747038878
  H   -9.44793227767195      0.50734980894719      4.94988721081591
  H   -7.67584655581606     -1.02124791175220      4.12229867494991
  H   -4.27739856569598     -5.60309721196111      7.36261987043646
  H   -2.72045416601639     -6.43444286589587      7.57965725721929
  H   -3.14134218855011     -5.07160805968778      8.63269574575759
  H   -3.18682317426899     -3.52435229777871      6.69609018274300
  H   -0.89673613672865     -3.16989065850160      6.33800107880881
  H   -1.19858807503935     -3.64084517253151      8.01703065360417
  H   -0.64987837913101     -6.21443681528396      8.60560883654082
  H   1.11451076607847     -7.91885860876149      8.33543564061657
  H   3.14360583020314     -8.34294624833795      5.37281214007398
  H   2.78932925541865     -8.95333820812318      6.98674960398020
  H   5.40188683593064     -9.34057020088188      5.97948468249688
  H   7.69897878600627     -8.70489244682305      6.66365900890743
  H   8.08272877192243     -6.60471242382861      7.95716808110590
  H   6.13945086063508     -5.16597120173685      8.56720729243301
  H   3.84629866964186     -5.80611250478708      7.87487730653763
  H   2.65003808055256     -5.80352073712699      4.91724255721740
  H   0.87168624901951     -4.10983814417182      5.17750257283862
  N   -4.41717988963653     -2.17422363478363      4.77011817308678
  H   -3.76358211244669     -1.39117172105605      4.69775697264279
  H   -4.90217801015160     -2.07445950935338      5.66581786288754
