113
Coordinates from ORCA-job /scratch/magstr/orcajob__5668101-fEqO/orca
  N   -2.80325188793179     -3.49810367762687      2.42217063766009
  C   -2.18784685523239     -4.40540593712735      1.43689025219960
  C   -2.27035564000401     -5.85721303807697      1.87422152971588
  N   -3.61653234567645     -6.12373881224390      2.40386471153697
  C   -4.66794144589471     -6.07657998023208      1.37847153801410
  C   -6.00613163892201     -5.80429375575361      2.03339476376162
  N   -5.90866022337968     -4.75627246135956      3.06055978892160
  Mo  -4.02535602474520     -4.38630549468060      3.76704397221684
  N   -3.05933224290100     -5.66436932152334      4.98586826968335
  C   -2.93214242858479     -7.05649591109973      4.55698246127322
  C   -3.71046990004915     -7.30404088342152      3.27498450763192
  H   -3.32866541261348     -7.75390473677956      5.31840274206691
  H   -1.87221532134009     -7.33796024796881      4.40972448898572
  H   -4.77439555779179     -7.44315415764802      3.50996277990496
  H   -3.34914515932790     -8.21519696020412      2.76204542139284
  H   -6.69078021818429     -5.50935780114921      1.22233126434355
  H   -6.42586966950650     -6.74126558702187      2.45076128127875
  H   -4.42256685591384     -5.25241165156008      0.69641613167426
  H   -4.69715796035878     -7.01235843429922      0.78888650318475
  H   -1.11752970007860     -4.18337971330953      1.29496988430227
  H   -2.64844499495069     -4.28503345026038      0.43784179884918
  H   -1.55526819261043     -6.03912956541343      2.68752457833445
  H   -2.02272568091044     -6.53605202977504      1.03626345460725
  C   -2.54977224418362     -2.06632109213354      2.06830901963863
  C   -1.04069547387154     -1.81174843660898      1.81683863577989
  C   -0.10248353566343     -2.31412031712138      2.91116622354634
  C   1.36500170473388     -2.05399789081866      2.57312638126690
  C   2.34621126433135     -2.78263431425581      3.47044817270654
  Cl  2.30155773241435     -4.57826002229725      3.18741638224799
  C   -3.04228789836949     -1.14102836651581      3.19066314258338
  C   -3.00761817508187      0.34897794932875      2.84052134326817
  C   -3.82954242768384      0.63527083919412      1.58241761057782
  C   -3.35637550828302     -0.23520786499194      0.41775344925394
  C   -3.35810091961370     -1.72255236098324      0.78720573712709
  C   -7.26448581453346     -4.41827794900273      3.59812710550301
  C   -7.75349078894077     -5.54260520743380      4.55279364461840
  C   -6.86282705785106     -5.79967911048497      5.76366719173138
  C   -7.19885268790650     -7.07697631194173      6.54094658044675
  C   -8.54344326091733     -6.98823670544202      7.23757671208186
  Cl  -8.88787339213848     -8.47647525077040      8.21429422608228
  C   -7.27421847869927     -3.07375388735644      4.34560822929200
  C   -6.97663603338060     -1.88048038665346      3.43688988690070
  C   -7.95537714851607     -1.79465897154488      2.26474736920568
  C   -8.01815716085151     -3.12634247804059      1.51199754863034
  C   -8.32792324005952     -4.27127819257052      2.47576587578876
  C   -2.46076772388500     -5.35519944295943      6.33583821470602
  C   -3.63983542143088     -5.34167209132440      7.33558619539515
  C   -3.37163159801505     -4.85055998482551      8.75674606743406
  C   -4.65161678236047     -4.86031852453515      9.59181318704309
  C   -4.48889859850396     -4.32310000834494     10.99958767485774
  Cl  -3.40026396214994     -5.36812800240003     12.01310984250330
  C   -1.41475599214392     -6.40992771374881      6.77873443260052
  C   -0.05235090702930     -6.18982096184718      6.12004644710996
  C   0.59926491183969     -4.90084359243525      6.66060277226643
  C   -0.47085431085903     -3.89867277599928      7.12921115333892
  C   -1.73199673233651     -3.97876865436026      6.26572344305862
  H   -0.74549274694640     -2.26276504452135      0.85465379151045
  H   -0.89150649973115     -0.73070837217445      1.67885538434560
  H   -0.25375612507878     -3.39375356106202      3.06267128347981
  H   -0.34595081427450     -1.83954117660626      3.87537443235295
  H   1.56820486458623     -2.33153092808851      1.52560943301943
  H   1.58659501463334     -0.97494575413437      2.65707781316422
  H   2.11653601767812     -2.64435614019446      4.53511789350507
  H   3.38339620240420     -2.48449987467098      3.27974638527863
  H   -4.08538816507031     -1.40692968267610      3.39889969623674
  H   -2.48726502010308     -1.34071828430998      4.11723509244930
  H   -1.97161761238136      0.69915168128815      2.69391703260294
  H   -3.40381980391385      0.92139079088550      3.69415399756580
  H   -3.77635275163517      1.70233910596268      1.31429916893947
  H   -4.89130990644051      0.41124758613323      1.79106742732962
  H   -2.34185841108819      0.07586857174626      0.11513689069891
  H   -3.99950213773802     -0.08039491757179     -0.46359028730346
  H   -2.97768979354270     -2.30814989685254     -0.06395226619190
  H   -4.39620929323275     -2.05412445996069      0.96551340818886
  H   -8.77471470223830     -5.27682585707509      4.87309343297556
  H   -7.85498089206125     -6.47819467243098      3.97498949815730
  H   -6.89227116547369     -4.93872917731370      6.45182098734058
  H   -5.81762145178879     -5.87325959208707      5.42417592612782
  H   -6.42028843914357     -7.26081666328765      7.29782630584021
  H   -7.19720211527911     -7.94386488323442      5.85980664694983
  H   -9.37735116474941     -6.89644449957496      6.53211486673086
  H   -8.57505524765414     -6.14817932868212      7.94344244882291
  H   -6.58367343252605     -3.10244202306454      5.19345317493446
  H   -8.28639124128315     -2.95943506426836      4.77187286907285
  H   -6.99928857437394     -0.94700569491241      4.02284409281662
  H   -5.95528443652129     -1.98530293510900      3.04004406208332
  H   -7.66726689195186     -0.97761839578134      1.58383280691783
  H   -8.96352146154055     -1.55120158978759      2.64566723003778
  H   -7.04887869327554     -3.30913420364976      1.01637360944598
  H   -8.78014841796263     -3.08416995644947      0.71759312701777
  H   -8.48052361235897     -5.21936938824290      1.94013840168951
  H   -9.28638568641730     -4.06160084763711      2.98033271895166
  H   -4.42139769994753     -4.70619426510658      6.89842277655037
  H   -4.05350803764759     -6.36589095270010      7.38103149931095
  H   -2.61225143784386     -5.46922175131744      9.25978249667087
  H   -2.97810944076714     -3.82115691305349      8.72737460076278
  H   -5.07402439267018     -5.87807109078526      9.63432566967822
  H   -5.41017225453253     -4.22487745227093      9.09879186423143
  H   -4.02965897113886     -3.32633865163757     11.00447074506699
  H   -5.44283296064679     -4.28697919264340     11.53827126143652
  H   -1.78712102551733     -7.42959583105732      6.62078592541090
  H   -1.29270660935125     -6.31655453773479      7.86911387838288
  H   -0.18259413411063     -6.10776875645374      5.02820940763853
  H   0.60583310849281     -7.05568085615266      6.28703846193211
  H   1.27507966807458     -5.14107594065680      7.49670681306087
  H   1.22317936663804     -4.45163324413333      5.87359595278274
  H   -0.07167332628618     -2.87249922438573      7.09682551131944
  H   -0.72657516140916     -4.08738003785889      8.18316114379659
  H   -2.42857509943066     -3.17386412816228      6.53043102491031
  H   -1.44828784164120     -3.80769392846426      5.21583981771038
  N   -4.32317036583519     -3.08142648062445      4.95392058930732
  N   -4.44322270756716     -2.25392462176425      5.88497570462172
  H   -5.13118704953929     -1.51634132387975      5.65328441220046
