89
Coordinates from ORCA-job /scratch/magstr/orcajob__5661735-nut3/orca
  N   -2.52613923676628     -3.87208454521762      2.63791460140831
  C   -2.07080782558223     -4.81980159895979      1.61966097437740
  C   -1.97051131234705     -6.20743941663329      2.24616248740972
  N   -3.15581575843472     -6.46726722521118      3.12073538495516
  C   -4.34518468804878     -6.88009517572697      2.31954955610065
  C   -5.62123171693216     -6.63549659283604      3.11481991813878
  N   -5.53323599410626     -5.31740742308291      3.73805423598974
  Mo  -3.68686152284111     -4.63848992687146      4.06155435293071
  N   -2.74161145378272     -5.45178966772387      5.58530785930324
  C   -2.07289820700198     -6.73932405700810      5.32215984126982
  C   -2.82574636787007     -7.44802809050806      4.20479753859041
  H   -2.05737354753716     -7.40808416212538      6.20143523976414
  H   -1.01110161056323     -6.59773501719386      5.03112684780167
  H   -3.78209744897418     -7.82695992849179      4.59203502987098
  H   -2.25199616256084     -8.29930932026934      3.79534155064390
  H   -6.48251663127929     -6.71943896863010      2.42420172867626
  H   -5.74896202156745     -7.43917372295225      3.86660458824166
  H   -4.34801381014749     -6.25242464263256      1.41750272717676
  H   -4.25541161209798     -7.93836829994501      2.01176206748884
  H   -1.07458023687048     -4.56209885724544      1.21268971549618
  H   -2.75981447215518     -4.83752610395375      0.75221329551982
  H   -1.08405711122531     -6.24877779250942      2.89457261273097
  H   -1.88309989667091     -7.00745177776975      1.48887089757862
  C   0.53029783235936     -1.78310591645437      2.91527420784085
  N   -0.50571680590031     -2.74661641174937      3.24010185764527
  C   -1.86963239935499     -2.58387598765815      2.69016645606210
  C   -1.93026690235273     -1.81571425145517      1.33243567008156
  C   -3.35574979300300     -1.58968883185893      0.89909244132943
  C   -4.18187266047397     -0.68821001427118      1.59837323368885
  C   -5.52063450091211     -0.50737305226338      1.24478300600151
  C   -6.06039361394533     -1.22414274540811      0.17471000455897
  C   -5.24581484351067     -2.11397051148957     -0.53650269073561
  C   -3.90708818519301     -2.29199075131801     -0.17578130659913
  C   -7.69864890570579     -6.91369603713190      5.81262497546275
  N   -6.77280377656814     -5.77762241940358      5.83050135277716
  C   -6.62949541722532     -4.92849396430541      4.62449348274984
  C   -7.96007416637658     -4.74987364730383      3.86226640097171
  C   -8.97456646239490     -3.82202942722480      4.48845386393734
  C   -9.82024558081401     -3.07769260712587      3.66385172141511
  C   -10.78263653851048     -2.21199143528573      4.19168956335039
  C   -10.91313478910694     -2.08546609656178      5.58150786705211
  C   -10.07065838049191     -2.82373762296906      6.42342682056940
  C   -9.11108708585135     -3.67655235067798      5.87790404342401
  C   -3.44444353420827     -6.46125464394161      8.30406926328191
  N   -3.25095730858589     -5.04626935579596      7.98047768616175
  C   -2.39588281923829     -4.75418653151608      6.82870051762423
  C   -0.89680816520746     -4.87710012325284      7.19251548467060
  C   -0.43149490182399     -3.80847387843272      8.14085559551218
  C   -0.48088970861893     -3.99108293932531      9.53147365103648
  C   -0.06536862146593     -2.98200627007728     10.39975873951701
  C   0.40153701103869     -1.76452148400116      9.89484647593858
  C   0.44977675329961     -1.56605908807843      8.51019578765185
  C   0.03923007106278     -2.58135322808714      7.64344057028920
  H   0.75305474936137     -1.67262522797273      1.83586445474681
  H   1.45390859163314     -2.08927307179935      3.42372434897605
  H   0.26186597100398     -0.79139301906886      3.29975562350974
  H   -0.19300372067556     -3.70628568316292      3.09441300575475
  H   -2.45531809147965     -1.97172175235963      3.40876358018991
  H   -1.37356799992178     -2.37325989194802      0.55842769101964
  H   -1.41951600510784     -0.85051718996683      1.46184690853082
  H   -3.76766315391884     -0.11945476204254      2.43490482323926
  H   -6.14677393801303      0.19501487648444      1.80522904092784
  H   -7.11017377251456     -1.08827694835042     -0.10156143867407
  H   -5.65609862292139     -2.67759156055148     -1.37850914474147
  H   -3.27598819568527     -2.99061540305586     -0.73775522385084
  H   -7.56189259458653     -7.48508715164846      6.74939896806483
  H   -8.74434290359707     -6.55762692097753      5.79830883911940
  H   -7.58102383197279     -7.62267593244829      4.96939123281871
  H   -5.83028699359971     -6.07949237331741      6.09977068540810
  H   -6.33778790090009     -3.92103143183418      4.98934800964566
  H   -7.69600589576770     -4.35997476524282      2.86771520992250
  H   -8.42340972982440     -5.73699062188506      3.68585831456517
  H   -9.71744955440697     -3.17592704490749      2.58489471459719
  H   -11.43362867147998     -1.64091119136550      3.52270846184256
  H   -11.66147841788339     -1.41164689889274      6.00373434076266
  H   -10.15846209507203     -2.72406252719342      7.50574855699680
  H   -8.44384359205541     -4.23903804589244      6.54003214963002
  H   -2.48770025872785     -6.91728200839588      8.55478735660873
  H   -3.90695704431538     -7.06064610125565      7.49370225262361
  H   -4.08664402983555     -6.54994888010320      9.18712386069634
  H   -4.16661333326343     -4.62587602157337      7.79444624643158
  H   -2.57440847147278     -3.68926735246057      6.62107011760141
  H   -0.33454574860159     -4.79020266904326      6.25329479067868
  H   -0.68751742268111     -5.87230219830268      7.60722453231640
  H   -0.84979389241975     -4.93804894190084      9.93210699752418
  H   -0.10413172833707     -3.14638719152584     11.47541735892927
  H   0.73583790408279     -0.97829027252220     10.57989823494983
  H   0.81851829116298     -0.62068558608980      8.10389789374460
  H   0.08570494823835     -2.42667229950293      6.55805541016056
