74
Coordinates from ORCA-job orca E -7352.416857084897
  N      -3.299990     -4.104629      1.780195
  C      -3.805971     -4.923889      0.696654
  C      -4.047198     -6.320856      1.264270
  N      -3.179782     -6.455892      2.441457
  C      -3.472423     -7.712695      3.169925
  C      -4.047856     -7.352752      4.542140
  N      -4.658109     -6.052812      4.369625
  Mo     -3.595202     -4.570232      3.642811
  N      -1.859007     -5.276228      4.195996
  C      -0.974374     -6.036384      3.330942
  C      -1.752913     -6.408094      2.069950
  H      -0.641960     -6.934242      3.864955
  H      -0.094407     -5.434414      3.076987
  H      -1.427249     -7.377057      1.678720
  H      -1.577574     -5.661649      1.293727
  H      -4.771792     -8.105491      4.856570
  H      -3.265696     -7.289772      5.311740
  H      -4.208491     -8.291244      2.606606
  H      -2.573189     -8.318592      3.282136
  H      -3.094947     -4.962130     -0.134012
  H      -4.733514     -4.471227      0.325605
  H      -3.813416     -7.090374      0.519731
  H      -5.088489     -6.437036      1.586035
  C      -2.684486     -2.951328      1.427320
  C      -2.383500     -2.492724      0.129391
  C      -1.766638     -1.277312     -0.038991
  C      -1.465885     -0.462349      1.058583
  C      -1.749645     -0.882868      2.334449
  C      -2.315720     -2.152338      2.541662
  N      -2.714241     -2.643529      3.748529
  C      -2.208023     -2.084639      4.856416
  C      -0.859435     -1.720137      5.069671
  O      -0.379068     -1.064248      5.960904
  Cl      0.283872     -2.552045      3.950826
  C      -5.918643     -5.829973      4.810057
  C      -6.736010     -6.674983      5.579240
  C      -8.020413     -6.287734      5.882295
  C      -8.534345     -5.074283      5.419524
  C      -7.746495     -4.216940      4.685565
  C      -6.420284     -4.567983      4.397857
  N      -5.522678     -3.818240      3.666224
  C      -5.802201     -2.512325      3.541144
  C      -5.398691     -1.741090      2.431255
  O      -5.007640     -2.090636      1.348001
  Cl     -5.633406      0.024200      2.736555
  C      -1.441755     -5.112685      5.469058
  C      -0.170902     -5.439020      5.985639
  C       0.128735     -5.152284      7.292352
  C      -0.802601     -4.508061      8.120244
  C      -2.051452     -4.198174      7.652830
  C      -2.415018     -4.538626      6.334732
  N      -3.605301     -4.253288      5.746051
  C      -4.668710     -3.915364      6.484581
  C      -4.999503     -4.499897      7.734761
  O      -4.572023     -5.461593      8.310211
  Cl     -6.441770     -3.651290      8.442770
  H      -2.655799     -3.064241     -0.741288
  H      -1.539946     -0.926673     -1.033690
  H      -1.029768      0.511791      0.900591
  H      -1.571633     -0.234903      3.180755
  H      -2.861130     -1.933994      5.717978
  H      -6.367494     -7.617258      5.949393
  H      -8.644805     -6.936482      6.476619
  H      -9.556260     -4.807456      5.637750
  H      -8.161533     -3.296931      4.305485
  H      -6.442411     -2.024602      4.268364
  H       0.584869     -5.871797      5.352651
  H       1.106249     -5.389709      7.682103
  H      -0.523285     -4.234590      9.125438
  H      -2.748483     -3.655222      8.269629
  H      -5.370178     -3.204046      6.080453
  N      -5.018756     -5.389362      2.286559
  N      -5.855512     -5.870841      1.489363
  H      -5.397546     -6.305775      0.680799
74
Coordinates from ORCA-job orca E -7352.514718874497
  N      -3.280872     -4.098805      1.755297
  C      -3.780200     -4.923047      0.665023
  C      -4.035619     -6.329796      1.242716
  N      -3.164686     -6.466590      2.434038
  C      -3.459905     -7.724343      3.172573
  C      -4.041537     -7.360037      4.547704
  N      -4.664296     -6.060049      4.378466
  Mo     -3.593282     -4.570824      3.635435
  N      -1.847716     -5.284185      4.196409
  C      -0.959407     -6.048029      3.331066
  C      -1.731561     -6.420358      2.067160
  H      -0.629604     -6.946750      3.867980
  H      -0.076356     -5.447194      3.079057
  H      -1.403564     -7.391425      1.679136
  H      -1.554180     -5.675320      1.289068
  H      -4.763259     -8.115210      4.866363
  H      -3.255668     -7.293739      5.314165
  H      -4.194081     -8.308569      2.609370
  H      -2.557062     -8.327378      3.288711
  H      -3.059493     -4.964028     -0.161418
  H      -4.702375     -4.468741      0.282352
  H      -3.796689     -7.106523      0.495398
  H      -5.111648     -6.455317      1.570023
  C      -2.657302     -2.943895      1.404508
  C      -2.347453     -2.490886      0.104984
  C      -1.727162     -1.274398     -0.063273
  C      -1.432583     -0.454736      1.037469
  C      -1.725727     -0.872519      2.314705
  C      -2.295523     -2.143257      2.521336
  N      -2.700467     -2.635944      3.733652
  C      -2.190971     -2.076409      4.848506
  C      -0.837586     -1.709956      5.079329
  O      -0.379832     -1.053442      5.984671
  Cl      0.339605     -2.532461      3.975719
  C      -5.926918     -5.833614      4.825209
  C      -6.737550     -6.681369      5.600575
  C      -8.024959     -6.295991      5.913532
  C      -8.544561     -5.081673      5.453521
  C      -7.759625     -4.220612      4.712011
  C      -6.434478     -4.569648      4.416337
  N      -5.540496     -3.806607      3.672460
  C      -5.846802     -2.498267      3.554056
  C      -5.483166     -1.699444      2.444168
  O      -5.108855     -2.026801      1.343753
  Cl     -5.757854      0.056594      2.782259
  C      -1.434058     -5.119233      5.477512
  C      -0.163264     -5.448557      5.996152
  C       0.135077     -5.161996      7.307047
  C      -0.799083     -4.515480      8.135119
  C      -2.049654     -4.203131      7.664032
  C      -2.411116     -4.543154      6.343461
  N      -3.607982     -4.253068      5.748859
  C      -4.680402     -3.910826      6.479295
  C      -5.028754     -4.496580      7.731892
  O      -4.605023     -5.462974      8.309984
  Cl     -6.477304     -3.640145      8.424455
  H      -2.616578     -3.067431     -0.767467
  H      -1.493257     -0.926160     -1.060693
  H      -0.993175      0.521434      0.879801
  H      -1.551453     -0.221218      3.162175
  H      -2.849246     -1.926905      5.705728
  H      -6.362336     -7.625482      5.968906
  H      -8.645582     -6.948178      6.513823
  H      -9.568409     -4.815244      5.678909
  H      -8.178920     -3.298219      4.333395
  H      -6.489760     -2.031368      4.295273
  H       0.594874     -5.883413      5.361762
  H       1.114711     -5.401531      7.699203
  H      -0.520815     -4.241522      9.143917
  H      -2.748485     -3.657840      8.281781
  H      -5.377139     -3.196847      6.066615
  N      -5.041272     -5.385358      2.274330
  N      -5.927712     -5.856985      1.463018
  H      -5.501401     -6.294566      0.627560
74
Coordinates from ORCA-job orca E -7352.589306231180
  N      -3.266999     -4.090618      1.729254
  C      -3.759700     -4.922922      0.635695
  C      -4.026929     -6.336095      1.224027
  N      -3.151923     -6.475583      2.426758
  C      -3.449063     -7.734364      3.174155
  C      -4.036969     -7.369567      4.552159
  N      -4.673853     -6.071422      4.388529
  Mo     -3.594693     -4.571964      3.629766
  N      -1.836654     -5.291601      4.199404
  C      -0.945422     -6.057418      3.331816
  C      -1.713198     -6.429420      2.065240
  H      -0.616913     -6.956980      3.870466
  H      -0.059972     -5.457056      3.081331
  H      -1.382907     -7.401981      1.679184
  H      -1.535728     -5.684740      1.285985
  H      -4.755669     -8.128571      4.873313
  H      -3.247626     -7.300471      5.315478
  H      -4.180814     -8.323413      2.610056
  H      -2.542010     -8.333545      3.292970
  H      -3.031031     -4.965803     -0.186553
  H      -4.679370     -4.470769      0.242311
  H      -3.784556     -7.117776      0.475618
  H      -5.132474     -6.471255      1.555778
  C      -2.638817     -2.931877      1.383228
  C      -2.323527     -2.481150      0.083622
  C      -1.702392     -1.261373     -0.082293
  C      -1.413710     -0.439146      1.022479
  C      -1.713279     -0.857613      2.300440
  C      -2.283754     -2.130722      2.503569
  N      -2.692530     -2.626730      3.720829
  C      -2.181117     -2.068159      4.839492
  C      -0.823606     -1.696418      5.081794
  O      -0.388117     -1.040432      5.999211
  Cl      0.380103     -2.503973      3.983753
  C      -5.939360     -5.839411      4.839527
  C      -6.743964     -6.689728      5.619425
  C      -8.034463     -6.305979      5.940918
  C      -8.558632     -5.090693      5.483881
  C      -7.775872     -4.225468      4.736014
  C      -6.452507     -4.572787      4.433758
  N      -5.559083     -3.797650      3.679657
  C      -5.871130     -2.486970      3.562547
  C      -5.508235     -1.689088      2.446054
  O      -5.131808     -2.026364      1.344697
  Cl     -5.783324      0.070252      2.780890
  C      -1.428054     -5.124657      5.487489
  C      -0.157120     -5.455726      6.007798
  C       0.139526     -5.168932      7.322419
  C      -0.798042     -4.521167      8.150636
  C      -2.050514     -4.207702      7.676145
  C      -2.408746     -4.547498      6.353731
  N      -3.611766     -4.253433      5.755551
  C      -4.689117     -3.908171      6.480539
  C      -5.047917     -4.496692      7.736731
  O      -4.622064     -5.466622      8.312711
  Cl     -6.499662     -3.635411      8.421497
  H      -2.589618     -3.061213     -0.791035
  H      -1.463797     -0.912798     -1.081658
  H      -0.973442      0.539995      0.866616
  H      -1.542911     -0.204686      3.150189
  H      -2.842301     -1.923849      5.694762
  H      -6.362624     -7.635585      5.985649
  H      -8.651792     -6.961644      6.545932
  H      -9.584182     -4.824477      5.715414
  H      -8.198770     -3.300834      4.359193
  H      -6.515450     -2.021482      4.305956
  H       0.603364     -5.891786      5.372030
  H       1.121305     -5.409438      7.716650
  H      -0.521246     -4.246489      9.162716
  H      -2.751756     -3.661157      8.294813
  H      -5.382916     -3.192022      6.062890
  N      -5.068251     -5.384737      2.259405
  N      -6.004014     -5.838068      1.440604
  H      -5.615373     -6.272474      0.589819
74
Coordinates from ORCA-job orca E -7352.645324016838
  N      -3.250773     -4.084085      1.702665
  C      -3.734940     -4.925717      0.607404
  C      -4.015304     -6.341255      1.205561
  N      -3.139460     -6.483726      2.417744
  C      -3.440330     -7.741883      3.173773
  C      -4.034266     -7.377089      4.553086
  N      -4.683457     -6.081857      4.396233
  Mo     -3.596383     -4.572936      3.622879
  N      -1.826592     -5.298217      4.202878
  C      -0.933098     -6.065580      3.333273
  C      -1.696340     -6.437441      2.063487
  H      -0.605910     -6.965707      3.873627
  H      -0.045317     -5.465983      3.084517
  H      -1.363973     -7.411289      1.679422
  H      -1.518995     -5.692983      1.283430
  H      -4.750340     -8.139742      4.875840
  H      -3.241989     -7.305952      5.313593
  H      -4.169235     -8.334629      2.607807
  H      -2.530042     -8.337761      3.296073
  H      -2.997879     -4.972250     -0.209068
  H      -4.651664     -4.476236      0.201983
  H      -3.769476     -7.127486      0.457715
  H      -5.147981     -6.484177      1.541457
  C      -2.617306     -2.922986      1.363831
  C      -2.293798     -2.475463      0.065230
  C      -1.671325     -1.253213     -0.097607
  C      -1.390469     -0.428211      1.010060
  C      -1.698674     -0.846021      2.287994
  C      -2.270300     -2.120329      2.487241
  N      -2.683738     -2.617859      3.707862
  C      -2.172460     -2.063296      4.828978
  C      -0.811511     -1.688118      5.082865
  O      -0.397894     -1.035818      6.012167
  Cl      0.414500     -2.482081      3.989251
  C      -5.949712     -5.844224      4.851456
  C      -6.747166     -6.697714      5.635083
  C      -8.039421     -6.316162      5.966950
  C      -8.567684     -5.099979      5.515609
  C      -7.788017     -4.230347      4.762220
  C      -6.467810     -4.575802      4.451941
  N      -5.578750     -3.788421      3.688558
  C      -5.901137     -2.477835      3.575490
  C      -5.550454     -1.678010      2.452507
  O      -5.181660     -2.020682      1.347955
  Cl     -5.832064      0.082277      2.788832
  C      -1.424854     -5.128908      5.496000
  C      -0.154359     -5.461843      6.018329
  C       0.140446     -5.174066      7.335434
  C      -0.799656     -4.524291      8.162666
  C      -2.053094     -4.209584      7.684854
  C      -2.408095     -4.549796      6.361522
  N      -3.615436     -4.251586      5.761072
  C      -4.695079     -3.902101      6.480401
  C      -5.062952     -4.492039      7.740078
  O      -4.634821     -5.464014      8.312901
  Cl     -6.515726     -3.625102      8.418113
  H      -2.555414     -3.059127     -0.811178
  H      -1.426339     -0.905199     -1.098097
  H      -0.949050      0.553052      0.855967
  H      -1.533441     -0.191115      3.139356
  H      -2.836502     -1.925552      5.682618
  H      -6.359459     -7.645286      5.997041
  H      -8.652461     -6.975733      6.576004
  H      -9.593916     -4.833904      5.754537
  H      -8.214192     -3.303206      4.389075
  H      -6.545135     -2.018023      4.324668
  H       0.607801     -5.899658      5.381892
  H       1.123703     -5.415454      7.731673
  H      -0.524374     -4.248298      9.177183
  H      -2.755930     -3.661268      8.303793
  H      -5.385666     -3.183905      6.058053
  N      -5.097151     -5.385066      2.239930
  N      -6.076370     -5.813596      1.420545
  H      -5.722730     -6.244626      0.557142
74
Coordinates from ORCA-job orca E -7352.687641086268
  N      -3.236618     -4.078580      1.678871
  C      -3.710362     -4.930076      0.583134
  C      -4.002679     -6.344668      1.188739
  N      -3.128981     -6.490581      2.408304
  C      -3.434603     -7.747007      3.172266
  C      -4.033883     -7.383609      4.551722
  N      -4.693277     -6.092095      4.402525
  Mo     -3.600018     -4.574112      3.616805
  N      -1.819531     -5.303294      4.207176
  C      -0.924352     -6.071027      3.335593
  C      -1.682723     -6.443036      2.062385
  H      -0.597806     -6.971444      3.877227
  H      -0.034740     -5.471964      3.088555
  H      -1.348028     -7.417572      1.679817
  H      -1.506013     -5.698283      1.282186
  H      -4.747256     -8.150328      4.874445
  H      -3.239528     -7.311403      5.310239
  H      -4.160240     -8.342225      2.603275
  H      -2.521984     -8.340144      3.298276
  H      -2.965229     -4.980865     -0.226863
  H      -4.624360     -4.484492      0.165590
  H      -3.753205     -7.134782      0.442401
  H      -5.159191     -6.494022      1.529386
  C      -2.599812     -2.915929      1.348408
  C      -2.268673     -2.470974      0.051041
  C      -1.646690     -1.246102     -0.108807
  C      -1.374623     -0.418475      1.000694
  C      -1.690640     -0.835623      2.278262
  C      -2.261594     -2.111056      2.474018
  N      -2.677785     -2.609280      3.696899
  C      -2.167441     -2.059845      4.819598
  C      -0.804402     -1.680233      5.082959
  O      -0.410132     -1.033045      6.023048
  Cl      0.439328     -2.458521      3.989431
  C      -5.958983     -5.849484      4.860769
  C      -6.750043     -6.706459      5.646813
  C      -8.043199     -6.327606      5.988129
  C      -8.575200     -5.110687      5.543293
  C      -7.799137     -4.236671      4.786071
  C      -6.481717     -4.579711      4.468297
  N      -5.597528     -3.781269      3.698329
  C      -5.923679     -2.472121      3.587518
  C      -5.571238     -1.677624      2.457961
  O      -5.201357     -2.032396      1.356979
  Cl     -5.848462      0.086831      2.786319
  C      -1.424682     -5.131994      5.503122
  C      -0.154416     -5.466812      6.026733
  C       0.139616     -5.177861      7.344994
  C      -0.801610     -4.525893      8.171373
  C      -2.055542     -4.209998      7.691519
  C      -2.408655     -4.550817      6.368027
  N      -3.618884     -4.248704      5.767441
  C      -4.698147     -3.894339      6.482648
  C      -5.072481     -4.484525      7.745907
  O      -4.641707     -5.457470      8.315032
  Cl     -6.523722     -3.611299      8.419849
  H      -2.525145     -3.058187     -0.826538
  H      -1.396137     -0.898556     -1.109872
  H      -0.933581      0.564871      0.848117
  H      -1.531264     -0.178626      3.130687
  H      -2.832968     -1.930987      5.673104
  H      -6.356566     -7.655398      6.003842
  H      -8.651864     -6.991245      6.599948
  H      -9.601619     -4.845106      5.789044
  H      -8.228520     -3.307488      4.417455
  H      -6.568586     -2.013045      4.337669
  H       0.608333     -5.906394      5.389487
  H       1.124124     -5.419930      7.742172
  H      -0.527015     -4.248367      9.187354
  H      -2.758772     -3.659866      8.310955
  H      -5.385914     -3.174266      6.056910
  N      -5.130205     -5.384695      2.219977
  N      -6.144947     -5.783337      1.406921
  H      -5.822354     -6.211348      0.529466
74
Coordinates from ORCA-job orca E -7352.722224571515
  N      -3.222858     -4.075087      1.658660
  C      -3.685454     -4.936445      0.563709
  C      -3.987533     -6.346633      1.174633
  N      -3.119557     -6.496142      2.398827
  C      -3.431282     -7.749758      3.169435
  C      -4.035347     -7.389003      4.547925
  N      -4.702019     -6.101264      4.406368
  Mo     -3.603781     -4.574849      3.611405
  N      -1.814535     -5.306786      4.211782
  C      -0.917999     -6.074213      3.338945
  C      -1.671069     -6.446752      2.062321
  H      -0.591958     -6.974750      3.881632
  H      -0.026735     -5.475770      3.093810
  H      -1.334113     -7.421512      1.680994
  H      -1.494689     -5.701399      1.282557
  H      -4.746303     -8.159886      4.868866
  H      -3.240016     -7.317074      5.305652
  H      -4.153421     -8.345965      2.596146
  H      -2.517483     -8.341181      3.299451
  H      -2.933331     -4.992840     -0.239806
  H      -4.596490     -4.494627      0.134584
  H      -3.734448     -7.140558      0.430946
  H      -5.160829     -6.498765      1.521306
  C      -2.583375     -2.912563      1.335922
  C      -2.244676     -2.470609      0.039332
  C      -1.623697     -1.243921     -0.118675
  C      -1.360592     -0.413546      0.991479
  C      -1.684109     -0.829064      2.268790
  C      -2.253899     -2.104934      2.462578
  N      -2.671676     -2.602177      3.687294
  C      -2.161548     -2.056951      4.810915
  C      -0.797539     -1.673835      5.080820
  O      -0.417305     -1.031396      6.029231
  Cl      0.458129     -2.439089      3.984844
  C      -5.966222     -5.854824      4.866841
  C      -6.752153     -6.715437      5.653868
  C      -8.045591     -6.339519      6.003373
  C      -8.580897     -5.121796      5.565688
  C      -7.808318     -4.243781      4.806665
  C      -6.492980     -4.584219      4.482261
  N      -5.614791     -3.775152      3.708314
  C      -5.947313     -2.469755      3.600429
  C      -5.595034     -1.676755      2.466868
  O      -5.224059     -2.038061      1.369114
  Cl     -5.875122      0.089241      2.791321
  C      -1.426144     -5.134298      5.508839
  C      -0.156068     -5.471368      6.033657
  C       0.137682     -5.181432      7.352192
  C      -0.803639     -4.527004      8.177881
  C      -2.057329     -4.209638      7.696751
  C      -2.409580     -4.550979      6.373258
  N      -3.620656     -4.244979      5.773799
  C      -4.698581     -3.885165      6.485321
  C      -5.079242     -4.474564      7.751295
  O      -4.647548     -5.448242      8.317610
  Cl     -6.527831     -3.594390      8.421122
  H      -2.495986     -3.061572     -0.838504
  H      -1.367884     -0.897611     -1.119969
  H      -0.920247      0.571298      0.839747
  H      -1.530519     -0.169646      3.121370
  H      -2.826830     -1.936316      5.665512
  H      -6.353874     -7.665559      6.005444
  H      -8.650187     -7.007304      6.616489
  H      -9.607102     -4.856936      5.817356
  H      -8.240393     -3.312746      4.443227
  H      -6.595868     -2.014961      4.350643
  H       0.606522     -5.912726      5.395812
  H       1.123000     -5.424296      7.749700
  H      -0.529231     -4.248049      9.194575
  H      -2.759977     -3.657579      8.316666
  H      -5.383423     -3.163315      6.056458
  N      -5.164538     -5.380531      2.201766
  N      -6.203376     -5.744296      1.403828
  H      -5.907976     -6.169964      0.512157
74
Coordinates from ORCA-job orca E -7352.753143813093
  N      -3.210825     -4.072218      1.643102
  C      -3.663948     -4.943258      0.549787
  C      -3.971415     -6.347570      1.164897
  N      -3.111433     -6.500089      2.391312
  C      -3.429326     -7.750622      3.167281
  C      -4.037486     -7.394090      4.545041
  N      -4.708984     -6.110006      4.409668
  Mo     -3.607190     -4.574895      3.607095
  N      -1.810988     -5.308993      4.216104
  C      -0.913126     -6.075845      3.343103
  C      -1.661436     -6.448917      2.063966
  H      -0.587640     -6.976519      3.886699
  H      -0.020300     -5.478149      3.099903
  H      -1.322988     -7.423827      1.683581
  H      -1.484980     -5.703012      1.284834
  H      -4.746030     -8.169212      4.863285
  H      -3.241865     -7.323329      5.302725
  H      -4.147882     -8.346985      2.589146
  H      -2.514937     -8.340765      3.300985
  H      -2.906304     -5.005588     -0.248116
  H      -4.571608     -4.504647      0.110667
  H      -3.713481     -7.146623      0.425384
  H      -5.152168     -6.497413      1.517723
  C      -2.570033     -2.911656      1.325898
  C      -2.225768     -2.472658      0.028856
  C      -1.606567     -1.244865     -0.128841
  C      -1.351177     -0.411906      0.981534
  C      -1.680366     -0.825280      2.259068
  C      -2.248353     -2.101273      2.452743
  N      -2.666199     -2.596876      3.679017
  C      -2.154640     -2.053452      4.803693
  C      -0.790588     -1.668908      5.077207
  O      -0.418314     -1.028854      6.030553
  Cl      0.472123     -2.425650      3.977411
  C      -5.970219     -5.859989      4.870334
  C      -6.753411     -6.723574      5.658074
  C      -8.046366     -6.350178      6.012477
  C      -8.584922     -5.131449      5.579648
  C      -7.815864     -4.250672      4.820312
  C      -6.500882     -4.588348      4.491052
  N      -5.630036     -3.769657      3.715447
  C      -5.969856     -2.468705      3.609501
  C      -5.617289     -1.673865      2.473969
  O      -5.241919     -2.037101      1.379900
  Cl     -5.903932      0.091391      2.798376
  C      -1.428231     -5.136219      5.513184
  C      -0.158191     -5.475539      6.039115
  C       0.135256     -5.185568      7.357652
  C      -0.805941     -4.529444      8.183342
  C      -2.058959     -4.210695      7.701595
  C      -2.410945     -4.551852      6.377728
  N      -3.621465     -4.242308      5.780677
  C      -4.697503     -3.878229      6.490413
  C      -5.082575     -4.467227      7.758021
  O      -4.650638     -5.442071      8.321580
  Cl     -6.528384     -3.581607      8.425934
  H      -2.472853     -3.067505     -0.848409
  H      -1.346731     -0.900077     -1.130349
  H      -0.911828      0.574119      0.829962
  H      -1.531492     -0.163354      3.111151
  H      -2.818494     -1.938129      5.659906
  H      -6.351699     -7.674310      6.005903
  H      -8.647890     -7.021231      6.626242
  H      -9.611094     -4.867616      5.835142
  H      -8.250681     -3.318685      4.461106
  H      -6.623762     -2.019459      4.358521
  H       0.604123     -5.917948      5.400683
  H       1.121139     -5.429245      7.755111
  H      -0.531550     -4.249849      9.200528
  H      -2.760862     -3.657406      8.322206
  H      -5.380397     -3.154871      6.059964
  N      -5.201564     -5.370499      2.186016
  N      -6.249984     -5.698237      1.410871
  H      -5.976732     -6.122408      0.503229
74
Coordinates from ORCA-job orca E -7352.782177654820
  N      -3.201530     -4.071610      1.629306
  C      -3.643675     -4.952710      0.536634
  C      -3.952145     -6.351904      1.154002
  N      -3.103663     -6.504584      2.382738
  C      -3.427608     -7.751414      3.163785
  C      -4.039312     -7.397856      4.540239
  N      -4.714416     -6.116845      4.411210
  Mo     -3.611372     -4.575217      3.601968
  N      -1.810171     -5.311032      4.218883
  C      -0.910433     -6.076944      3.346953
  C      -1.652599     -6.450827      2.065106
  H      -0.585590     -6.977510      3.891607
  H      -0.016243     -5.479811      3.106295
  H      -1.311923     -7.425763      1.686209
  H      -1.475553     -5.704600      1.286559
  H      -4.745325     -8.176836      4.856233
  H      -3.243263     -7.328135      5.297768
  H      -4.142203     -8.348106      2.580854
  H      -2.512942     -8.340499      3.301983
  H      -2.880393     -5.019445     -0.255112
  H      -4.548794     -4.518521      0.087126
  H      -3.687410     -7.155070      0.420596
  H      -5.130837     -6.499282      1.510608
  C      -2.560416     -2.912258      1.317130
  C      -2.210542     -2.475365      0.020077
  C      -1.593873     -1.246172     -0.137113
  C      -1.346447     -0.410401      0.973125
  C      -1.680745     -0.821864      2.250334
  C      -2.246382     -2.098534      2.444027
  N      -2.663830     -2.592831      3.670892
  C      -2.151619     -2.051687      4.796245
  C      -0.788294     -1.664855      5.072072
  O      -0.421356     -1.028360      6.029848
  Cl      0.479403     -2.412648      3.967642
  C      -5.972150     -5.863077      4.873817
  C      -6.752902     -6.729439      5.663097
  C      -8.043782     -6.357985      6.024540
  C      -8.585158     -5.137297      5.598549
  C      -7.820282     -4.254084      4.838942
  C      -6.505812     -4.589394      4.502066
  N      -5.643350     -3.763274      3.725142
  C      -5.986514     -2.465093      3.621893
  C      -5.631204     -1.670127      2.484360
  O      -5.252377     -2.036336      1.393628
  Cl     -5.916999      0.095591      2.808248
  C      -1.432252     -5.138382      5.515917
  C      -0.162376     -5.479789      6.043432
  C       0.130612     -5.189921      7.361790
  C      -0.810450     -4.532330      8.187198
  C      -2.062581     -4.212265      7.704661
  C      -2.414321     -4.553037      6.380281
  N      -3.623708     -4.240418      5.784866
  C      -4.699395     -3.872567      6.491147
  C      -5.090704     -4.460747      7.759170
  O      -4.659848     -5.436002      8.322373
  Cl     -6.535689     -3.570961      8.421984
  H      -2.452879     -3.073734     -0.856565
  H      -1.330421     -0.902629     -1.138491
  H      -0.908947      0.576838      0.821677
  H      -1.536977     -0.157533      3.101774
  H      -2.813810     -1.943098      5.654504
  H      -6.348454     -7.681212      6.005841
  H      -8.641850     -7.032005      6.639095
  H      -9.610406     -4.874087      5.859757
  H      -8.257698     -3.320805      4.485673
  H      -6.643047     -2.017965      4.370119
  H       0.599689     -5.923076      5.404863
  H       1.116697     -5.434279      7.759333
  H      -0.536240     -4.252280      9.204655
  H      -2.763770     -3.657953      8.325600
  H      -5.380039     -3.148456      6.057647
  N      -5.238384     -5.361019      2.167527
  N      -6.282619     -5.656147      1.417580
  H      -6.028946     -6.077699      0.497906
74
Coordinates from ORCA-job orca E -7352.809803036718
  N      -3.194669     -4.072973      1.617944
  C      -3.625347     -4.963404      0.525308
  C      -3.932285     -6.358088      1.143041
  N      -3.096910     -6.509141      2.374217
  C      -3.426816     -7.751846      3.159794
  C      -4.041486     -7.400280      4.534466
  N      -4.718679     -6.121726      4.411099
  Mo     -3.616158     -4.575522      3.596724
  N      -1.811756     -5.312631      4.220914
  C      -0.909681     -6.077374      3.351112
  C      -1.644961     -6.452284      2.066594
  H      -0.585544     -6.977637      3.896966
  H      -0.014237     -5.480665      3.113398
  H      -1.301602     -7.427147      1.689508
  H      -1.466925     -5.705897      1.288607
  H      -4.745213     -8.182658      4.848240
  H      -3.245297     -7.331648      5.292127
  H      -4.137355     -8.348817      2.572168
  H      -2.512360     -8.340322      3.302945
  H      -2.856462     -5.033266     -0.260099
  H      -4.528171     -4.534026      0.065711
  H      -3.660114     -7.164476      0.417227
  H      -5.100693     -6.502011      1.500624
  C      -2.553719     -2.914424      1.309865
  C      -2.198690     -2.479206      0.013000
  C      -1.585164     -1.248498     -0.143995
  C      -1.345569     -0.409644      0.965646
  C      -1.684304     -0.819211      2.242275
  C      -2.247080     -2.096924      2.436462
  N      -2.663605     -2.589914      3.663463
  C      -2.151177     -2.050988      4.789226
  C      -0.788955     -1.661939      5.066466
  O      -0.424935     -1.028931      6.027594
  Cl      0.481752     -2.401568      3.957090
  C      -5.972959     -5.865062      4.875887
  C      -6.751913     -6.734392      5.666199
  C      -8.040277     -6.365102      6.034458
  C      -8.584233     -5.142074      5.615839
  C      -7.823440     -4.256388      4.856953
  C      -6.509091     -4.589098      4.512278
  N      -5.654980     -3.757005      3.735587
  C      -5.999400     -2.460962      3.635277
  C      -5.638921     -1.666190      2.496735
  O      -5.256135     -2.034952      1.409131
  Cl     -5.921232      0.100105      2.820221
  C      -1.437556     -5.140554      5.517779
  C      -0.168004     -5.484160      6.046901
  C       0.124745     -5.194412      7.364924
  C      -0.815818     -4.535190      8.189976
  C      -2.066867     -4.213606      7.706627
  C      -2.418458     -4.553989      6.381808
  N      -3.626105     -4.238374      5.787785
  C      -4.700612     -3.866487      6.491794
  C      -5.096122     -4.453323      7.760388
  O      -4.666467     -5.428789      8.323671
  Cl     -6.538776     -3.559057      8.420462
  H      -2.436144     -3.080927     -0.862851
  H      -1.318616     -0.906196     -1.145115
  H      -0.910479      0.578755      0.814027
  H      -1.545720     -0.152541      3.092887
  H      -2.811536     -1.949197      5.649639
  H      -6.345169     -7.687261      6.003413
  H      -8.635113     -7.042077      6.649157
  H      -9.608359     -4.879730      5.882711
  H      -8.263149     -3.321745      4.510145
  H      -6.658309     -2.014451      4.381977
  H       0.593612     -5.928445      5.408431
  H       1.110766     -5.439571      7.762484
  H      -0.541676     -4.254774      9.207453
  H      -2.767307     -3.658171      8.327536
  H      -5.379044     -3.141431      6.056406
  N      -5.275027     -5.350358      2.147853
  N      -6.304473     -5.616259      1.424355
  H      -6.068317     -6.035041      0.494507
74
Coordinates from ORCA-job orca E -7352.835621527689
  N      -3.190191     -4.076128      1.609407
  C      -3.609116     -4.974626      0.516298
  C      -3.912933     -6.365687      1.131981
  N      -3.091512     -6.513601      2.366367
  C      -3.427156     -7.752109      3.155483
  C      -4.043962     -7.401764      4.528114
  N      -4.721565     -6.124810      4.409576
  Mo     -3.621221     -4.575886      3.591723
  N      -1.815186     -5.313739      4.222746
  C      -0.910443     -6.077128      3.355904
  C      -1.638658     -6.453107      2.068964
  H      -0.586946     -6.976986      3.902909
  H      -0.013872     -5.480731      3.121332
  H      -1.292321     -7.427784      1.693758
  H      -1.459328     -5.706588      1.291617
  H      -4.745710     -8.187063      4.839674
  H      -3.247935     -7.334465      5.286214
  H      -4.133734     -8.349217      2.563342
  H      -2.513399     -8.340549      3.303618
  H      -2.834308     -5.045996     -0.262353
  H      -4.509581     -4.550194      0.046694
  H      -3.632690     -7.174375      0.414739
  H      -5.063435     -6.505471      1.486543
  C      -2.549697     -2.918020      1.304234
  C      -2.190238     -2.484215      0.007627
  C      -1.580324     -1.251919     -0.149696
  C      -1.348078     -0.409715      0.958890
  C      -1.690398     -0.817431      2.234860
  C      -2.249914     -2.096458      2.430060
  N      -2.664956     -2.588113      3.656950
  C      -2.152435     -2.050953      4.782738
  C      -0.791476     -1.659552      5.060141
  O      -0.428069     -1.029731      6.023498
  Cl      0.480252     -2.392106      3.945542
  C      -5.972565     -5.866228      4.876935
  C      -6.750150     -6.738597      5.667833
  C      -8.035792     -6.371559      6.042699
  C      -8.582045     -5.145955      5.631754
  C      -7.825064     -4.257838      4.874283
  C      -6.510622     -4.587881      4.521812
  N      -5.664485     -3.751129      3.746423
  C      -6.008556     -2.456641      3.648933
  C      -5.640843     -1.661773      2.510741
  O      -5.253105     -2.032076      1.426033
  Cl     -5.917913      0.104901      2.834623
  C      -1.443498     -5.142641      5.519306
  C      -0.174319     -5.488491      6.049865
  C       0.118507     -5.198755      7.367388
  C      -0.821201     -4.537648      8.192104
  C      -2.071093     -4.214442      7.708065
  C      -2.422837     -4.554651      6.382924
  N      -3.628391     -4.236327      5.789853
  C      -4.701535     -3.860389      6.492408
  C      -5.100406     -4.445597      7.761307
  O      -4.672685     -5.421366      8.325237
  Cl     -6.540639     -3.547251      8.419204
  H      -2.422937     -3.089137     -0.867244
  H      -1.311375     -0.910916     -1.150563
  H      -0.915861      0.579780      0.806698
  H      -1.556871     -0.148540      3.084522
  H      -2.810568     -1.955839      5.645555
  H      -6.341476     -7.692580      5.999249
  H      -8.627670     -7.051374      6.657055
  H      -9.604909     -4.884648      5.904149
  H      -8.266659     -3.321764      4.534182
  H      -6.669863     -2.009765      4.393359
  H       0.586672     -5.933880      5.411669
  H       1.104315     -5.444729      7.764817
  H      -0.546880     -4.256788      9.209326
  H      -2.770614     -3.657694      8.328648
  H      -5.378006     -3.134508      6.055613
  N      -5.311667     -5.338286      2.127129
  N      -6.318863     -5.579132      1.428613
  H      -6.097840     -5.995219      0.489418
74
Coordinates from ORCA-job orca E -7352.858789390413
  N      -3.187862     -4.080957      1.603438
  C      -3.594375     -4.985947      0.509180
  C      -3.894386     -6.374782      1.119936
  N      -3.087613     -6.517864      2.359485
  C      -3.428684     -7.752558      3.150762
  C      -4.046896     -7.402945      4.521269
  N      -4.723353     -6.126541      4.406784
  Mo     -3.626381     -4.576349      3.587207
  N      -1.819900     -5.314464      4.225100
  C      -0.912277     -6.076272      3.361729
  C      -1.633592     -6.452992      2.072707
  H      -0.589260     -6.975797      3.909576
  H      -0.014683     -5.480082      3.130419
  H      -1.283983     -7.427302      1.699209
  H      -1.452721     -5.706186      1.296221
  H      -4.747015     -8.190737      4.830527
  H      -3.251393     -7.337379      5.280191
  H      -4.131440     -8.349673      2.554267
  H      -2.516018     -8.341551      3.303609
  H      -2.812480     -5.056625     -0.261601
  H      -4.492005     -4.566697      0.028753
  H      -3.604573     -7.184807      0.411844
  H      -5.020465     -6.510981      1.465998
  C      -2.547945     -2.922892      1.299927
  C      -2.184912     -2.490519      0.003516
  C      -1.578969     -1.256537     -0.154880
  C      -1.353475     -0.410638      0.952168
  C      -1.698488     -0.816501      2.227633
  C      -2.254333     -2.097022      2.424462
  N      -2.667379     -2.587304      3.651358
  C      -2.154774     -2.051255      4.776828
  C      -0.795013     -1.657264      5.053465
  O      -0.430758     -1.030170      6.018191
  Cl      0.476552     -2.383992      3.934055
  C      -5.971531     -5.866962      4.877174
  C      -6.748084     -6.742522      5.667924
  C      -8.031099     -6.377723      6.049193
  C      -8.579173     -5.149282      5.646355
  C      -7.825380     -4.258584      4.891082
  C      -6.510802     -4.586029      4.531065
  N      -5.671824     -3.745426      3.757803
  C      -6.014612     -2.451858      3.663054
  C      -5.638251     -1.655927      2.526924
  O      -5.244532     -2.026211      1.444697
  Cl     -5.909500      0.110697      2.852747
  C      -1.449584     -5.144651      5.521240
  C      -0.180827     -5.492836      6.053046
  C       0.112345     -5.202863      7.369976
  C      -0.826242     -4.539460      8.194341
  C      -2.074950     -4.214475      7.709656
  C      -2.427050     -4.554837      6.384305
  N      -3.630282     -4.234008      5.791653
  C      -4.701628     -3.853817      6.493917
  C      -5.102483     -4.436841      7.763316
  O      -4.676877     -5.412863      8.328368
  Cl     -6.539840     -3.534452      8.420231
  H      -2.413133     -3.098610     -0.870170
  H      -1.308388     -0.916997     -1.155654
  H      -0.924546      0.579946      0.798876
  H      -1.569821     -0.145424      3.076230
  H      -2.810326     -1.962708      5.642248
  H      -6.337873     -7.697775      5.993174
  H      -8.620453     -7.060374      6.662603
  H      -9.600730     -4.889088      5.924047
  H      -8.268254     -3.320816      4.557955
  H      -6.678579     -2.004265      4.404672
  H       0.579427     -5.939577      5.415315
  H       1.097856     -5.449686      7.767213
  H      -0.551501     -4.257987      9.211101
  H      -2.773452     -3.656112      8.329620
  H      -5.376533     -3.127198      6.056348
  N      -5.348672     -5.325055      2.104578
  N      -6.331172     -5.546751      1.425057
  H      -6.121639     -5.960580      0.476807
74
Coordinates from ORCA-job orca E -7352.879029035718
  N      -3.187196     -4.087309      1.599586
  C      -3.580095     -4.996985      0.503319
  C      -3.876517     -6.385234      1.106231
  N      -3.085142     -6.521729      2.353689
  C      -3.431289     -7.753387      3.145491
  C      -4.050290     -7.404345      4.514017
  N      -4.724304     -6.127432      4.403047
  Mo     -3.631458     -4.576983      3.583400
  N      -1.825339     -5.314955      4.228599
  C      -0.914772     -6.074911      3.368817
  C      -1.629575     -6.451644      2.078043
  H      -0.592032     -6.974343      3.916957
  H      -0.016220     -5.478846      3.140836
  H      -1.276415     -7.425329      1.705792
  H      -1.446980     -5.704222      1.302787
  H      -4.749158     -8.194236      4.820852
  H      -3.255637     -7.341046      5.274113
  H      -4.130464     -8.350348      2.544841
  H      -2.519997     -8.343514      3.302413
  H      -2.789166     -5.064440     -0.257744
  H      -4.473859     -4.583296      0.010293
  H      -3.574788     -7.195570      0.407602
  H      -4.974462     -6.519639      1.437833
  C      -2.547855     -2.928906      1.296656
  C      -2.182082     -2.498089      0.000308
  C      -1.580402     -1.262312     -0.159902
  C      -1.361080     -0.412416      0.945172
  C      -1.707960     -0.816440      2.220398
  C      -2.259720     -2.098529      2.419385
  N      -2.670262     -2.587378      3.646593
  C      -2.157405     -2.051622      4.771321
  C      -0.798637     -1.654621      5.046234
  O      -0.432699     -1.029618      6.011605
  Cl      0.471990     -2.376627      3.922482
  C      -5.970176     -5.867562      4.877064
  C      -6.745852     -6.746528      5.666827
  C      -8.026407     -6.383836      6.054541
  C      -8.575699     -5.152230      5.660531
  C      -7.824392     -4.258648      4.908228
  C      -6.509856     -4.583719      4.540811
  N      -5.677055     -3.739634      3.770229
  C      -6.018086     -2.446458      3.678350
  C      -5.632156     -1.648064      2.546140
  O      -5.231544     -2.016497      1.465953
  Cl     -5.897665      0.117971      2.876022
  C      -1.455488     -5.146570      5.524208
  C      -0.187203     -5.497242      6.057032
  C       0.106596     -5.206607      7.373254
  C      -0.830573     -4.540280      8.197177
  C      -2.078101     -4.213286      7.711925
  C      -2.430852     -4.554314      6.386544
  N      -3.631681     -4.231163      5.793707
  C      -4.700999     -3.846486      6.496436
  C      -5.103172     -4.426751      7.766516
  O      -4.680084     -5.403031      8.333167
  Cl     -6.537716     -3.520346      8.422654
  H      -2.406125     -3.109326     -0.872049
  H      -1.308936     -0.924401     -1.160807
  H      -0.935812      0.579294      0.790279
  H      -1.583948     -0.143185      3.067860
  H      -2.809896     -1.969610      5.639627
  H      -6.334533     -7.703351      5.985355
  H      -8.613681     -7.069419      6.666392
  H      -9.595906     -4.893116      5.943447
  H      -8.267872     -3.318759      4.582553
  H      -6.685086     -1.998302      4.416875
  H       0.572199     -5.945746      5.419951
  H       1.091779     -5.454329      7.770267
  H      -0.555092     -4.257872      9.213275
  H      -2.775361     -3.652819      8.331012
  H      -5.374652     -3.119309      6.058291
  N      -5.387105     -5.311252      2.079545
  N      -6.347314     -5.521153      1.408942
  H      -6.144078     -5.933331      0.452224
74
Coordinates from ORCA-job orca E -7352.896408321882
  N      -3.187758     -4.095081      1.597655
  C      -3.565563     -5.007361      0.498286
  C      -3.859111     -6.396634      1.090822
  N      -3.083817     -6.525023      2.348987
  C      -3.434719     -7.754622      3.139534
  C      -4.054070     -7.406117      4.506308
  N      -4.724516     -6.127665      4.398376
  Mo     -3.636237     -4.577874      3.580432
  N      -1.831145     -5.315293      4.233478
  C      -0.917630     -6.073242      3.377138
  C      -1.626327     -6.449115      2.084829
  H      -0.595040     -6.972885      3.924998
  H      -0.018137     -5.477259      3.152535
  H      -1.269414     -7.421880      1.713168
  H      -1.441775     -5.700678      1.311265
  H      -4.752223     -8.197606      4.810574
  H      -3.260622     -7.345692      5.267960
  H      -4.130768     -8.351157      2.535044
  H      -2.525056     -8.346563      3.299617
  H      -2.763470     -5.069038     -0.250966
  H      -4.454041     -4.599510     -0.009387
  H      -3.542975     -7.206218      0.401657
  H      -4.929410     -6.531671      1.403351
  C      -2.548904     -2.936028      1.294327
  C      -2.181172     -2.506909     -0.002142
  C      -1.583988     -1.269257     -0.164848
  C      -1.370253     -0.415115      0.937850
  C      -1.718199     -0.817300      2.213122
  C      -2.265483     -2.100979      2.414724
  N      -2.673024     -2.588340      3.642543
  C      -2.159639     -2.052004      4.766071
  C      -0.801632     -1.651598      5.038412
  O      -0.433612     -1.027883      6.003765
  Cl      0.467649     -2.370149      3.911085
  C      -5.968593     -5.868178      4.876554
  C      -6.743463     -6.750851      5.664378
  C      -8.021754     -6.390175      6.058519
  C      -8.571648     -5.155095      5.674099
  C      -7.822162     -4.258216      4.925632
  C      -6.507876     -4.581131      4.551045
  N      -5.680145     -3.733745      3.783653
  C      -6.019293     -2.440637      3.695006
  C      -5.623711     -1.637981      2.568523
  O      -5.215955     -2.002437      1.489744
  Cl     -5.884302      0.126775      2.905114
  C      -1.461056     -5.148289      5.528475
  C      -0.193310     -5.501540      6.062157
  C       0.101314     -5.209674      7.377550
  C      -0.834176     -4.539736      8.200834
  C      -2.080524     -4.210545      7.715068
  C      -2.434182     -4.552871      6.389886
  N      -3.632567     -4.227618      5.796315
  C      -4.699603     -3.838256      6.500162
  C      -5.102444     -4.415191      7.771207
  O      -4.682070     -5.391597      8.339885
  Cl     -6.534222     -3.504669      8.426759
  H      -2.401349     -3.121189     -0.873120
  H      -1.312366     -0.933132     -1.166147
  H      -0.948972      0.577787      0.780891
  H      -1.598619     -0.141855      3.059398
  H      -2.808594     -1.976409      5.637516
  H      -6.331483     -7.709585      5.975612
  H      -8.607416     -7.078887      6.668126
  H      -9.590530     -4.897065      5.962114
  H      -8.265639     -3.315772      4.607928
  H      -6.689692     -1.992477      4.430460
  H       0.565181     -5.952305      5.425968
  H       1.086160     -5.458307      7.774396
  H      -0.557652     -4.255978      9.216090
  H      -2.776339     -3.647424      8.333028
  H      -5.372338     -3.110728      6.061607
  N      -5.428540     -5.297654      2.052027
  N      -6.370792     -5.503118      1.378993
  H      -6.168042     -5.914068      0.415398
74
Coordinates from ORCA-job orca E -7352.910994525906
  N      -3.189242     -4.104271      1.597836
  C      -3.550569     -5.016698      0.494500
  C      -3.841725     -6.408219      1.074528
  N      -3.083186     -6.527748      2.345612
  C      -3.438836     -7.756440      3.132778
  C      -4.058180     -7.408539      4.497996
  N      -4.723880     -6.127454      4.392405
  Mo     -3.640363     -4.579418      3.578331
  N      -1.836929     -5.315761      4.239846
  C      -0.920353     -6.071894      3.386807
  C      -1.623320     -6.446051      2.093073
  H      -0.598027     -6.972038      3.934003
  H      -0.019811     -5.476107      3.165651
  H      -1.262704     -7.417581      1.721038
  H      -1.436323     -5.696127      1.321803
  H      -4.756548     -8.200838      4.799408
  H      -3.266440     -7.351856      5.261758
  H      -4.132773     -8.351855      2.524967
  H      -2.531216     -8.351330      3.294571
  H      -2.735698     -5.070283     -0.241228
  H      -4.432235     -4.614618     -0.029431
  H      -3.509303     -7.215839      0.394174
  H      -4.889678     -6.545820      1.366050
  C      -2.550881     -2.944254      1.292918
  C      -2.182278     -2.516898     -0.003975
  C      -1.590003     -1.277235     -0.169908
  C      -1.381118     -0.418610      0.930019
  C      -1.728979     -0.819043      2.205679
  C      -2.271160     -2.104431      2.410353
  N      -2.674949     -2.590474      3.639006
  C      -2.160680     -2.052583      4.760850
  C      -0.803278     -1.648106      5.029746
  O      -0.433136     -1.024599      5.994399
  Cl      0.464658     -2.364372      3.899780
  C      -5.966716     -5.869129      4.875090
  C      -6.740941     -6.755889      5.659831
  C      -8.017269     -6.397208      6.059983
  C      -8.567118     -5.158364      5.685730
  C      -7.818691     -4.257714      4.942215
  C      -6.504734     -4.578671      4.561058
  N      -5.680668     -3.728193      3.797595
  C      -6.018013     -2.435003      3.712643
  C      -5.612863     -1.625845      2.593858
  O      -5.197882     -1.983857      1.515812
  Cl     -5.869915      0.136803      2.940368
  C      -1.466033     -5.149803      5.534207
  C      -0.198886     -5.505583      6.068669
  C       0.096754     -5.211550      7.383037
  C      -0.836775     -4.537114      8.205324
  C      -2.081969     -4.205689      7.719093
  C      -2.436858     -4.550326      6.394460
  N      -3.632852     -4.223400      5.799660
  C      -4.697552     -3.829279      6.505049
  C      -5.100760     -4.402400      7.777265
  O      -4.683373     -5.378749      8.348466
  Cl     -6.530306     -3.487794      8.431821
  H      -2.399002     -3.134011     -0.873615
  H      -1.319264     -0.942979     -1.171968
  H      -0.964341      0.575656      0.770471
  H      -1.613552     -0.141379      3.050738
  H      -2.805525     -1.983498      5.635761
  H      -6.328830     -7.716896      5.963335
  H      -8.601953     -7.089309      6.666502
  H      -9.584858     -4.901497      5.978417
  H      -8.261581     -3.312300      4.632906
  H      -6.692498     -1.987704      4.444995
  H       0.558681     -5.959262      5.433721
  H       1.081311     -5.460954      7.779838
  H      -0.558849     -4.251290      9.219505
  H      -2.776110     -3.639186      8.335601
  H      -5.369759     -3.101749      6.066056
  N      -5.474109     -5.284670      2.023047
  N      -6.402240     -5.490419      1.338778
  H      -6.195805     -5.899971      0.370760
74
Coordinates from ORCA-job orca E -7352.923292101845
  N      -3.191334     -4.114149      1.599836
  C      -3.535084     -5.024934      0.491748
  C      -3.823483     -6.419802      1.058169
  N      -3.082429     -6.530103      2.343331
  C      -3.442826     -7.758912      3.125402
  C      -4.062322     -7.411475      4.489159
  N      -4.722617     -6.126891      4.385125
  Mo     -3.643598     -4.581658      3.576997
  N      -1.842261     -5.316522      4.247286
  C      -0.922509     -6.071423      3.397424
  C      -1.619908     -6.443310      2.102106
  H      -0.600864     -6.972248      3.943950
  H      -0.020765     -5.476011      3.179852
  H      -1.255864     -7.413357      1.728836
  H      -1.429883     -5.691565      1.333587
  H      -4.762028     -8.203576      4.787581
  H      -3.272830     -7.359091      5.255575
  H      -4.135919     -8.352452      2.514994
  H      -2.537633     -8.357806      3.287470
  H      -2.706754     -5.068751     -0.229497
  H      -4.408911     -4.628471     -0.049140
  H      -3.473450     -7.224241      0.385624
  H      -4.859369     -6.562402      1.329251
  C      -2.553565     -2.952794      1.292281
  C      -2.185215     -2.527128     -0.005330
  C      -1.598047     -1.285405     -0.174941
  C      -1.393014     -0.422347      0.922014
  C      -1.739577     -0.821242      2.198368
  C      -2.276253     -2.108403      2.406287
  N      -2.675559     -2.593529      3.635868
  C      -2.159992     -2.053293      4.755616
  C      -0.803065     -1.644231      5.020239
  O      -0.431003     -1.019565      5.983407
  Cl      0.463567     -2.359276      3.888312
  C      -5.964726     -5.870318      4.872574
  C      -6.738533     -6.761312      5.653329
  C      -8.013151     -6.404343      6.058914
  C      -8.562250     -5.161534      5.695030
  C      -7.814158     -4.256877      4.957347
  C      -6.500620     -4.576321      4.570350
  N      -5.678599     -3.723115      3.811389
  C      -6.014198     -2.429801      3.730715
  C      -5.600706     -1.612391      2.620729
  O      -5.179850     -1.962138      1.542460
  Cl     -5.855218      0.147508      2.979979
  C      -1.470366     -5.150965      5.541047
  C      -0.203860     -5.508994      6.076322
  C       0.092796     -5.211928      7.389530
  C      -0.838689     -4.532410      8.210441
  C      -2.082803     -4.198954      7.723752
  C      -2.439091     -4.546832      6.399983
  N      -3.632918     -4.218833      5.803777
  C      -4.695399     -3.820467      6.510971
  C      -5.098543     -4.389824      7.784449
  O      -4.683830     -5.365821      8.358357
  Cl     -6.526701     -3.471661      8.437787
  H      -2.399014     -3.146585     -0.873870
  H      -1.329211     -0.952978     -1.178094
  H      -0.981037      0.573398      0.759537
  H      -1.627777     -0.141490      3.042284
  H      -2.800241     -1.990548      5.634225
  H      -6.326977     -7.724907      5.949005
  H      -8.597550     -7.099895      6.661680
  H      -9.579040     -4.905767      5.991858
  H      -8.255929     -3.308197      4.656615
  H      -6.692888     -1.984161      4.460391
  H       0.552887     -5.966096      5.442988
  H       1.077115     -5.461870      7.786498
  H      -0.559166     -4.243896      9.223390
  H      -2.775223     -3.628591      8.338541
  H      -5.367680     -3.093389      6.071623
  N      -5.525952     -5.273090      1.993310
  N      -6.440150     -5.482049      1.292462
  H      -6.227241     -5.889761      0.322961
74
Coordinates from ORCA-job orca E -7352.933905844933
  N      -3.193912     -4.123601      1.603064
  C      -3.519873     -5.032275      0.489961
  C      -3.804603     -6.430981      1.043340
  N      -3.081229     -6.532082      2.342242
  C      -3.446220     -7.761743      3.118256
  C      -4.066365     -7.414608      4.480452
  N      -4.721139     -6.126149      4.377061
  Mo     -3.645758     -4.584332      3.576381
  N      -1.846590     -5.317530      4.255342
  C      -0.923806     -6.071989      3.408528
  C      -1.615967     -6.441340      2.111482
  H      -0.603408     -6.973571      3.954628
  H      -0.020735     -5.477171      3.194553
  H      -1.249022     -7.409808      1.736365
  H      -1.422613     -5.687630      1.345874
  H      -4.768470     -8.205530      4.775860
  H      -3.279614     -7.366567      5.249961
  H      -4.139690     -8.352660      2.505908
  H      -2.543724     -8.365323      3.279466
  H      -2.678373     -5.065985     -0.216644
  H      -4.385531     -4.641441     -0.067772
  H      -3.436270     -7.231382      0.377873
  H      -4.838867     -6.581250      1.294823
  C      -2.556973     -2.960473      1.292194
  C      -2.190072     -2.536146     -0.006367
  C      -1.607974     -1.292364     -0.179713
  C      -1.405556     -0.425308      0.914371
  C      -1.749598     -0.823075      2.191662
  C      -2.280621     -2.112044      2.402700
  N      -2.674740     -2.596862      3.633306
  C      -2.157600     -2.054072      4.750923
  C      -0.801051     -1.640227      5.011007
  O      -0.427604     -1.013441      5.972287
  Cl      0.464547     -2.354594      3.877507
  C      -5.962971     -5.871527      4.869153
  C      -6.736766     -6.766489      5.645449
  C      -8.009953     -6.410615      6.055538
  C      -8.557585     -5.163845      5.701455
  C      -7.809093     -4.255387      4.969964
  C      -6.496007     -4.574042      4.578205
  N      -5.674320     -3.718695      3.824065
  C      -6.008021     -2.425180      3.747785
  C      -5.587737     -1.599315      2.646285
  O      -5.163062     -1.940751      1.567047
  Cl     -5.839232      0.157803      3.019272
  C      -1.473765     -5.151640      5.548526
  C      -0.207848     -5.511593      6.084516
  C       0.089900     -5.211029      7.396501
  C      -0.839513     -4.526265      8.215885
  C      -2.082728     -4.191056      7.728861
  C      -2.440647     -4.542705      6.406183
  N      -3.632852     -4.214212      5.808912
  C      -4.693219     -3.812659      6.518321
  C      -5.095497     -4.379068      7.793053
  O      -4.682503     -5.354569      8.369171
  Cl     -6.523041     -3.458376      8.445777
  H      -2.401635     -3.157176     -0.874223
  H      -1.342015     -0.961512     -1.184189
  H      -0.998417      0.571954      0.748899
  H      -1.640623     -0.141544      3.034608
  H      -2.793073     -1.997566      5.633271
  H      -6.326553     -7.732827      5.933829
  H      -8.594795     -7.109332      6.654237
  H      -9.573623     -4.908883      6.001678
  H      -8.249281     -3.303375      4.677426
  H      -6.690472     -1.981343      4.475318
  H       0.548112     -5.972375      5.452925
  H       1.074068     -5.461349      7.793702
  H      -0.558246     -4.234753      9.227533
  H      -2.773438     -3.616722      8.341914
  H      -5.366357     -3.086419      6.079119
  N      -5.584618     -5.264001      1.962652
  N      -6.482957     -5.478129      1.242388
  H      -6.261443     -5.883450      0.273534
74
Coordinates from ORCA-job orca E -7352.943218933434
  N      -3.196791     -4.131625      1.606903
  C      -3.505694     -5.038856      0.489281
  C      -3.786025     -6.441105      1.031787
  N      -3.079634     -6.533551      2.342688
  C      -3.448974     -7.764583      3.112309
  C      -4.070306     -7.417724      4.472709
  N      -4.719822     -6.125518      4.368897
  Mo     -3.646603     -4.587138      3.576445
  N      -1.849309     -5.318756      4.263695
  C      -0.924034     -6.073684      3.419766
  C      -1.611698     -6.440363      2.121059
  H      -0.605520     -6.976086      3.965731
  H      -0.019503     -5.479806      3.209157
  H      -1.242689     -7.407321      1.743658
  H      -1.415080     -5.684681      1.358284
  H      -4.775676     -8.206666      4.765104
  H      -3.286690     -7.373662      5.245626
  H      -4.143917     -8.352059      2.498476
  H      -2.549340     -8.373212      3.271746
  H      -2.651956     -5.063499     -0.203204
  H      -4.363303     -4.653790     -0.084634
  H      -3.399368     -7.237142      0.372967
  H      -4.825410     -6.601378      1.263361
  C      -2.561068     -2.966385      1.292511
  C      -2.196906     -2.542834     -0.007157
  C      -1.619661     -1.297040     -0.183969
  C      -1.418407     -0.426771      0.907616
  C      -1.758704     -0.823981      2.186035
  C      -2.284173     -2.114737      2.399830
  N      -2.672402     -2.599884      3.631573
  C      -2.153560     -2.054804      4.747244
  C      -0.797371     -1.635977      5.002702
  O      -0.423100     -1.006495      5.961923
  Cl      0.467308     -2.349199      3.867162
  C      -5.961641     -5.872560      4.865108
  C      -6.736024     -6.770729      5.636981
  C      -8.008024     -6.414959      6.050407
  C      -8.553421     -5.164407      5.704811
  C      -7.803758     -4.252877      4.979241
  C      -6.491156     -4.571821      4.584037
  N      -5.668191     -3.715215      3.834792
  C      -5.999749     -2.421350      3.762650
  C      -5.574746     -1.587839      2.668230
  O      -5.149422     -1.922007      1.587123
  Cl     -5.821805      0.166807      3.054776
  C      -1.475846     -5.151807      5.556320
  C      -0.210404     -5.513401      6.092862
  C       0.088579     -5.209275      7.403628
  C      -0.838786     -4.519447      8.221522
  C      -2.081337     -4.182792      7.734329
  C      -2.441135     -4.538319      6.412867
  N      -3.632486     -4.209846      5.815242
  C      -4.691011     -3.806688      6.527144
  C      -5.091633     -4.371677      7.802872
  O      -4.678938     -5.346635      8.380224
  Cl     -6.519679     -3.450326      8.455766
  H      -2.407124     -3.164546     -0.874792
  H      -1.357514     -0.967304     -1.189892
  H      -1.015917      0.571979      0.739336
  H      -1.651494     -0.141139      3.028266
  H      -2.784214     -2.004687      5.633287
  H      -6.328002     -7.739807      5.919211
  H      -8.594033     -7.116157      6.645159
  H      -9.568849     -4.909636      6.007556
  H      -8.241891     -3.297643      4.693949
  H      -6.684995     -1.979116      4.488813
  H       0.544711     -5.977889      5.462916
  H       1.072691     -5.459905      7.800991
  H      -0.555708     -4.224919      9.231877
  H      -2.770391     -3.604688      8.345830
  H      -5.365981     -3.081790      6.088641
  N      -5.649399     -5.258270      1.930529
  N      -6.529483     -5.479138      1.189336
  H      -6.297257     -5.881431      0.222201
74
Coordinates from ORCA-job orca E -7352.951368916589
  N      -3.199932     -4.137600      1.610914
  C      -3.493230     -5.044649      0.489990
  C      -3.768742     -6.449528      1.024674
  N      -3.077794     -6.534409      2.344995
  C      -3.451248     -7.767219      3.108275
  C      -4.074161     -7.420811      4.466676
  N      -4.718951     -6.125384      4.361252
  Mo     -3.645929     -4.589949      3.577170
  N      -1.849946     -5.320251      4.272141
  C      -0.923068     -6.076621      3.430966
  C      -1.607357     -6.440490      2.130888
  H      -0.607107     -6.979941      3.977031
  H      -0.016887     -5.484203      3.223232
  H      -1.237402     -7.406132      1.750819
  H      -1.407779     -5.682876      1.370772
  H      -4.783364     -8.207270      4.755998
  H      -3.293976     -7.380124      5.243221
  H      -4.148628     -8.350328      2.493179
  H      -2.554566     -8.381060      3.265092
  H      -2.628682     -5.062012     -0.189590
  H      -4.343296     -4.665597     -0.098808
  H      -3.364468     -7.241182      0.372004
  H      -4.815610     -6.621384      1.235151
  C      -2.566167     -2.970036      1.293187
  C      -2.206390     -2.546528     -0.007736
  C      -1.633969     -1.298713     -0.187662
  C      -1.432336     -0.426205      0.901938
  C      -1.767375     -0.823606      2.181685
  C      -2.287227     -2.116195      2.397880
  N      -2.668624     -2.602362      3.630913
  C      -2.148127     -2.055553      4.744902
  C      -0.792373     -1.631535      4.995872
  O      -0.417798     -0.999208      5.953086
  Cl      0.471495     -2.343204      3.858007
  C      -5.960817     -5.873347      4.860648
  C      -6.736644     -6.773538      5.628509
  C      -8.007697     -6.416629      6.043754
  C      -8.550050     -5.162649      5.704612
  C      -7.798329     -4.249213      4.984259
  C      -6.486175     -4.569735      4.587243
  N      -5.660344     -3.713083      3.842926
  C      -5.989028     -2.418570      3.774275
  C      -5.560617     -1.578867      2.685281
  O      -5.137515     -1.907371      1.601711
  Cl     -5.800305      0.173834      3.084688
  C      -1.476248     -5.151504      5.564219
  C      -0.211160     -5.514372      6.101245
  C       0.089145     -5.206760      7.410824
  C      -0.836313     -4.512282      8.227290
  C      -2.078417     -4.174630      7.739993
  C      -2.440180     -4.533958      6.419806
  N      -3.631456     -4.206058      5.822666
  C      -4.688597     -3.803217      6.537080
  C      -5.086728     -4.368559      7.813431
  O      -4.672447     -5.342754      8.390978
  Cl     -6.516655     -3.449156      8.467263
  H      -2.416393     -3.168152     -0.875461
  H      -1.376777     -0.969421     -1.195092
  H      -1.034430      0.574035      0.731148
  H      -1.660742     -0.139968      3.023449
  H      -2.774053     -2.012217      5.634512
  H      -6.331664     -7.745196      5.906248
  H      -8.595632     -7.119304      6.634978
  H      -9.564991     -4.907228      6.008763
  H      -8.233909     -3.291043      4.704697
  H      -6.675927     -1.977343      4.499730
  H       0.543037     -5.982438      5.472773
  H       1.073276     -5.457596      7.808249
  H      -0.551516     -4.214810      9.236388
  H      -2.766021     -3.593170      8.350122
  H      -5.366522     -3.080417      6.099661
  N      -5.718956     -5.256157      1.896915
  N      -6.578598     -5.484942      1.134275
  H      -6.333433     -5.883616      0.169254
74
Coordinates from ORCA-job orca E -7352.958423333081
  N      -3.203304     -4.141329      1.614931
  C      -3.483114     -5.049361      0.492281
  C      -3.753345     -6.455665      1.022229
  N      -3.075695     -6.534586      2.349280
  C      -3.453130     -7.769554      3.106400
  C      -4.077747     -7.423936      4.462804
  N      -4.718532     -6.126047      4.354588
  Mo     -3.643463     -4.592815      3.578610
  N      -1.848161     -5.322179      4.280675
  C      -0.920786     -6.080986      3.442182
  C      -1.602989     -6.441700      2.141063
  H      -0.608117     -6.985409      3.988467
  H      -0.012642     -5.490767      3.236728
  H      -1.233386     -7.406254      1.757856
  H      -1.400780     -5.682098      1.383526
  H      -4.790993     -8.207758      4.748936
  H      -3.301165     -7.385923      5.243083
  H      -4.153803     -8.347261      2.490087
  H      -2.559456     -8.388701      3.259710
  H      -2.609700     -5.061227     -0.176425
  H      -4.326808     -4.676482     -0.109240
  H      -3.332961     -7.242852      0.374702
  H      -4.806986     -6.639780      1.210605
  C      -2.572426     -2.971386      1.294323
  C      -2.218918     -2.547078     -0.007998
  C      -1.651248     -1.297294     -0.190649
  C      -1.447443     -0.423721      0.897592
  C      -1.775527     -0.822178      2.178846
  C      -2.289796     -2.116601      2.397069
  N      -2.663243     -2.604505      3.631493
  C      -2.141038     -2.056521      4.743857
  C      -0.785881     -1.626665      4.989827
  O      -0.410972     -0.991193      5.944741
  Cl      0.476545     -2.335512      3.848284
  C      -5.960294     -5.873902      4.856077
  C      -6.738607     -6.774651      5.620565
  C      -8.008965     -6.415256      6.035859
  C      -8.547434     -5.158305      5.700654
  C      -7.792641     -4.244418      4.984591
  C      -6.480858     -4.567905      4.587626
  N      -5.650678     -3.712683      3.848200
  C      -5.975692     -2.417153      3.782205
  C      -5.545510     -1.572712      2.696933
  O      -5.128313     -1.896904      1.609967
  Cl     -5.774651      0.178465      3.108601
  C      -1.474713     -5.150936      5.572251
  C      -0.209978     -5.514664      6.110013
  C       0.091464     -5.203623      7.418481
  C      -0.832404     -4.504952      8.233408
  C      -2.074154     -4.166849      7.745787
  C      -2.437596     -4.529899      6.426859
  N      -3.629365     -4.203219      5.830807
  C      -4.685987     -3.802802      6.547212
  C      -5.081289     -4.370220      7.823616
  O      -4.663602     -5.343246      8.400628
  Cl     -6.515128     -3.456076      8.478193
  H      -2.430139     -3.168024     -0.875900
  H      -1.400249     -0.967629     -1.199569
  H      -1.053974      0.577968      0.724688
  H      -1.668039     -0.138356      3.020422
  H      -2.762036     -2.020582      5.637114
  H      -6.337455     -7.748624      5.895734
  H      -8.599629     -7.118206      6.624117
  H      -9.562018     -4.901271      6.004857
  H      -8.225118     -3.283696      4.708806
  H      -6.662968     -1.976368      4.507738
  H       0.543323     -5.986153      5.482975
  H       1.075590     -5.454518      7.816045
  H      -0.546250     -4.204582      9.241324
  H      -2.760721     -3.582504      8.354509
  H      -5.367960     -3.083188      6.110758
  N      -5.791458     -5.257144      1.862916
  N      -6.629305     -5.494434      1.079256
  H      -6.369033     -5.889023      0.116642
74
Coordinates from ORCA-job orca E -7352.964505464409
  N      -3.206939     -4.142907      1.618919
  C      -3.475823     -5.052624      0.495971
  C      -3.740354     -6.459382      1.023829
  N      -3.073351     -6.534096      2.355357
  C      -3.454585     -7.771547      3.106666
  C      -4.080745     -7.427020      4.461315
  N      -4.718459     -6.127544      4.349208
  Mo     -3.639108     -4.595797      3.580813
  N      -1.843897     -5.324530      4.289266
  C      -0.917231     -6.086678      3.453291
  C      -1.598669     -6.443712      2.151381
  H      -0.608503     -6.992438      3.999774
  H      -0.006768     -5.499480      3.249428
  H      -1.230643     -7.407348      1.764491
  H      -1.394242     -5.681920      1.396434
  H      -4.797812     -8.208431      4.744240
  H      -3.307752     -7.390830      5.245239
  H      -4.159206     -8.342958      2.489141
  H      -2.563879     -8.395939      3.255656
  H      -2.595830     -5.060307     -0.164543
  H      -4.314895     -4.685643     -0.115299
  H      -3.306006     -7.241888      0.379866
  H      -4.798748     -6.655753      1.190057
  C      -2.579949     -2.970564      1.295981
  C      -2.234732     -2.544562     -0.007910
  C      -1.671879     -1.292842     -0.192969
  C      -1.464203     -0.419346      0.894526
  C      -1.783520     -0.819772      2.177433
  C      -2.292022     -2.116120      2.397433
  N      -2.656276     -2.606619      3.633319
  C      -2.132330     -2.058026      4.744168
  C      -0.777915     -1.622004      4.985091
  O      -0.402743     -0.983436      5.937699
  Cl      0.482929     -2.328642      3.840414
  C      -5.959905     -5.874250      4.851632
  C      -6.741771     -6.774067      5.613445
  C      -8.011802     -6.411031      6.026693
  C      -8.545723     -5.151711      5.692496
  C      -7.786846     -4.238843      4.979770
  C      -6.475215     -4.566455      4.585040
  N      -5.639238     -3.714239      3.850388
  C      -5.959707     -2.417267      3.785827
  C      -5.528967     -1.569730      2.702692
  O      -5.120611     -1.890968      1.611704
  Cl     -5.743502      0.180420      3.125878
  C      -1.471070     -5.150151      5.580363
  C      -0.206756     -5.514193      6.119320
  C       0.095377     -5.199681      7.426798
  C      -0.827411     -4.497345      8.239964
  C      -2.068834     -4.159471      7.751588
  C      -2.433306     -4.526222      6.433832
  N      -3.625901     -4.201491      5.839148
  C      -4.682946     -3.805422      6.556874
  C      -5.075044     -4.376104      7.832950
  O      -4.652029     -5.347193      8.409229
  Cl     -6.514565     -3.470295      8.487924
  H      -2.448713     -3.164500     -0.875843
  H      -1.428361     -0.961912     -1.203323
  H      -1.075150      0.583800      0.719913
  H      -1.673774     -0.136323      3.019040
  H      -2.748395     -2.029895      5.640988
  H      -6.344979     -7.749961      5.888093
  H      -8.605994     -7.113042      6.612551
  H      -9.560201     -4.892239      5.995070
  H      -8.215792     -3.276107      4.705388
  H      -6.646219     -1.976149      4.511987
  H       0.545798     -5.988913      5.493801
  H       1.079424     -5.450380      7.824751
  H      -0.540463     -4.194082      9.246811
  H      -2.755021     -3.572784      8.358675
  H      -5.369922     -3.090165      6.121063
  N      -5.865552     -5.260715      1.829968
  N      -6.681439     -5.506749      1.026502
  H      -6.404234     -5.897038      0.066754
74
Coordinates from ORCA-job orca E -7352.969752557979
  N      -3.210479     -4.142688      1.623119
  C      -3.471108     -5.054282      0.500904
  C      -3.729830     -6.460882      1.028624
  N      -3.070821     -6.533014      2.362912
  C      -3.455685     -7.773178      3.108790
  C      -4.082992     -7.429913      4.462037
  N      -4.718623     -6.129713      4.345175
  Mo     -3.632966     -4.598954      3.583873
  N      -1.837549     -5.327400      4.298036
  C      -0.912725     -6.093601      3.464284
  C      -1.594492     -6.446181      2.161637
  H      -0.608520     -7.001009      4.010765
  H       0.000445     -5.510250      3.261444
  H      -1.229018     -7.408975      1.770503
  H      -1.388290     -5.681855      1.409421
  H      -4.803311     -8.209404      4.741961
  H      -3.313334     -7.394632      5.249271
  H      -4.164628     -8.337660      2.490022
  H      -2.567828     -8.402599      3.252899
  H      -2.586817     -5.058626     -0.154238
  H      -4.307588     -4.692503     -0.116786
  H      -3.283918     -7.238465      0.386431
  H      -4.790877     -6.669024      1.173525
  C      -2.587941     -2.968050      1.298470
  C      -2.252398     -2.539522     -0.007031
  C      -1.693986     -1.286086     -0.194015
  C      -1.480823     -0.413842      0.893390
  C      -1.790179     -0.817039      2.177928
  C      -2.293394     -2.115181      2.399231
  N      -2.647742     -2.609054      3.636420
  C      -2.121732     -2.060092      4.745584
  C      -0.768309     -1.616708      4.980064
  O      -0.392257     -0.974041      5.929407
  Cl      0.489537     -2.318461      3.829465
  C      -5.959435     -5.874394      4.847624
  C      -6.745607     -6.771944      5.607592
  C      -8.015583     -6.404337      6.017063
  C      -8.544518     -5.143249      5.681134
  C      -7.780847     -4.232724      4.970670
  C      -6.469218     -4.565385      4.579996
  N      -5.626359     -3.717656      3.849698
  C      -5.941995     -2.418904      3.785580
  C      -5.513320     -1.569381      2.702952
  O      -5.118204     -1.888315      1.606611
  Cl     -5.710644      0.179960      3.137124
  C      -1.465625     -5.149542      5.588637
  C      -0.201863     -5.513448      6.129235
  C       0.100411     -5.195454      7.435846
  C      -0.821839     -4.489940      8.247006
  C      -2.062936     -4.152874      7.757439
  C      -2.427713     -4.523283      6.440709
  N      -3.621249     -4.201137      5.847211
  C      -4.679837     -3.810988      6.565331
  C      -5.069045     -4.385787      7.840580
  O      -4.639582     -5.354361      8.416214
  Cl     -6.516261     -3.491228      8.494602
  H      -2.470570     -3.158215     -0.874787
  H      -1.458697     -0.953057     -1.205617
  H      -1.095715      0.590629      0.717620
  H      -1.676772     -0.134574      3.019848
  H      -2.732311     -2.040106      5.646253
  H      -6.353350     -7.749308      5.883523
  H      -8.613872     -7.104289      6.601210
  H      -9.559105     -4.880678      5.980653
  H      -8.205990     -3.268534      4.695391
  H      -6.626475     -1.977113      4.513332
  H       0.550138     -5.991181      5.505308
  H       1.084284     -5.445717      7.834506
  H      -0.534668     -4.183808      9.252918
  H      -2.749378     -3.564320      8.362591
  H      -5.372372     -3.101109      6.129518
  N      -5.940303     -5.266416      1.798771
  N      -6.734908     -5.521248      0.977137
  H      -6.439330     -5.907270      0.020875
74
Coordinates from ORCA-job orca E -7352.974275736554
  N      -3.214019     -4.141061      1.627477
  C      -3.469071     -5.054642      0.506740
  C      -3.721528     -6.460749      1.035952
  N      -3.067956     -6.531428      2.371608
  C      -3.456176     -7.774358      3.112637
  C      -4.084217     -7.432238      4.464809
  N      -4.718830     -6.132126      4.342318
  Mo     -3.625242     -4.602182      3.587611
  N      -1.829473     -5.330418      4.306720
  C      -0.907414     -6.101215      3.474830
  C      -1.590338     -6.448659      2.171496
  H      -0.608123     -7.010505      4.021101
  H       0.008783     -5.522420      3.272461
  H      -1.227997     -7.410609      1.775712
  H      -1.382929     -5.681475      1.422161
  H      -4.806947     -8.210464      4.742242
  H      -3.317489     -7.396755      5.254865
  H      -4.169503     -8.331734      2.492654
  H      -2.570954     -8.408419      3.251710
  H      -2.582809     -5.055940     -0.146031
  H      -4.305489     -4.697685     -0.113816
  H      -3.266388     -7.233273      0.393789
  H      -4.783710     -6.680075      1.161214
  C      -2.596752     -2.964000      1.301430
  C      -2.272489     -2.532120     -0.005805
  C      -1.719142     -1.276788     -0.194510
  C      -1.499817     -0.406439      0.893206
  C      -1.797713     -0.813198      2.179369
  C      -2.294776     -2.113501      2.401887
  N      -2.638172     -2.611791      3.640363
  C      -2.110216     -2.062900      4.748251
  C      -0.757740     -1.613054      4.977673
  O      -0.381498     -0.967378      5.924758
  Cl      0.498722     -2.315796      3.826758
  C      -5.958918     -5.874136      4.843743
  C      -6.749998     -6.768329      5.602571
  C      -8.020307     -6.395597      6.006375
  C      -8.544119     -5.133450      5.665897
  C      -7.775163     -4.226327      4.956774
  C      -6.463221     -4.564507      4.572134
  N      -5.612420     -3.722553      3.845862
  C      -5.922575     -2.421669      3.780866
  C      -5.495844     -1.571601      2.697912
  O      -5.114227     -1.889271      1.596538
  Cl     -5.671635      0.177388      3.142279
  C      -1.458420     -5.148798      5.596700
  C      -0.195239     -5.512072      6.139166
  C       0.106671     -5.190597      7.445028
  C      -0.815613     -4.482494      8.254034
  C      -2.056462     -4.146780      7.762993
  C      -2.420858     -4.520737      6.447119
  N      -3.615370     -4.201804      5.854405
  C      -4.676141     -3.818552      6.572494
  C      -5.061957     -4.397535      7.846990
  O      -4.624561     -5.362627      8.422475
  Cl     -6.517367     -3.515696      8.500040
  H      -2.495894     -3.149655     -0.873039
  H      -1.493099     -0.940833     -1.207233
  H      -1.119141      0.599576      0.716601
  H      -1.679990     -0.131950      3.021646
  H      -2.716029     -2.050525      5.652157
  H      -6.362123     -7.746591      5.881560
  H      -8.623171     -7.092522      6.589427
  H      -9.559155     -4.867452      5.960807
  H      -8.196468     -3.261368      4.678223
  H      -6.604437     -1.978327      4.510235
  H       0.556378     -5.992575      5.516822
  H       1.090313     -5.440156      7.844689
  H      -0.528717     -4.173614      9.259172
  H      -2.743803     -3.556928      8.366035
  H      -5.374585     -3.114705      6.136406
  N      -6.015175     -5.274391      1.769828
  N      -6.789783     -5.538196      0.932025
  H      -6.474809     -5.920219     -0.019976
74
Coordinates from ORCA-job orca E -7352.978155377683
  N      -3.216904     -4.138391      1.632660
  C      -3.469011     -5.053519      0.513623
  C      -3.714962     -6.459015      1.045050
  N      -3.064885     -6.529407      2.381001
  C      -3.456320     -7.775128      3.117484
  C      -4.084623     -7.434014      4.468865
  N      -4.719056     -6.134578      4.340323
  Mo     -3.616308     -4.605490      3.592327
  N      -1.820622     -5.334076      4.315751
  C      -0.901967     -6.109807      3.485342
  C      -1.586302     -6.450953      2.181010
  H      -0.608267     -7.021404      4.030995
  H       0.017708     -5.536309      3.283548
  H      -1.227411     -7.411922      1.780071
  H      -1.377995     -5.680395      1.435006
  H      -4.808856     -8.211614      4.744513
  H      -3.320231     -7.397386      5.261083
  H      -4.173858     -8.325401      2.496217
  H      -2.573557     -8.413477      3.251622
  H      -2.582848     -5.051813     -0.139433
  H      -4.307704     -4.700809     -0.106428
  H      -3.252744     -7.226329      0.401354
  H      -4.777156     -6.688677      1.152666
  C      -2.604275     -2.959335      1.305694
  C      -2.290837     -2.523665     -0.002952
  C      -1.740683     -1.267198     -0.192481
  C      -1.513583     -0.399953      0.896206
  C      -1.800661     -0.810587      2.183647
  C      -2.294174     -2.112165      2.406313
  N      -2.627369     -2.615172      3.645481
  C      -2.096322     -2.066077      4.751284
  C      -0.745436     -1.606248      4.970675
  O      -0.366885     -0.953363      5.911763
  Cl      0.504421     -2.295162      3.805116
  C      -5.958156     -5.873635      4.840419
  C      -6.754096     -6.763827      5.598915
  C      -8.024704     -6.385638      5.996572
  C      -8.543425     -5.122875      5.650061
  C      -7.769291     -4.219854      4.941258
  C      -6.457107     -4.563826      4.563184
  N      -5.598332     -3.728457      3.840153
  C      -5.904107     -2.425434      3.774371
  C      -5.484457     -1.574710      2.689485
  O      -5.123641     -1.890423      1.580637
  Cl     -5.640654      0.173629      3.143542
  C      -1.450609     -5.149069      5.605157
  C      -0.188242     -5.511824      6.149760
  C       0.112685     -5.187211      7.455055
  C      -0.810063     -4.476825      8.261690
  C      -2.050549     -4.142416      7.768877
  C      -2.413949     -4.519542      6.453608
  N      -3.609217     -4.204029      5.860775
  C      -4.673183     -3.828379      6.577898
  C      -5.056984     -4.412130      7.850850
  O      -4.612301     -5.374015      8.426192
  Cl     -6.522683     -3.545219      8.500398
  H      -2.520402     -3.139677     -0.869648
  H      -1.523134     -0.927889     -1.205914
  H      -1.135423      0.606996      0.719551
  H      -1.677090     -0.131353      3.026723
  H      -2.695181     -2.061951      5.659795
  H      -6.370179     -7.742552      5.881824
  H      -8.632139     -7.078855      6.579279
  H      -9.558936     -4.853252      5.939944
  H      -8.186823     -3.254572      4.658075
  H      -6.581965     -1.981265      4.507067
  H       0.563131     -5.994882      5.529016
  H       1.095894     -5.436161      7.856129
  H      -0.523887     -4.165539      9.266269
  H      -2.739085     -3.551571      8.369687
  H      -5.377278     -3.130868      6.140734
  N      -6.089609     -5.283991      1.743041
  N      -6.845555     -5.556712      0.891182
  H      -6.510438     -5.934927     -0.055581
74
Coordinates from ORCA-job orca E -7352.981434634115
  N      -3.220000     -4.134817      1.637477
  C      -3.471664     -5.051631      0.520546
  C      -3.709966     -6.456640      1.055353
  N      -3.061028     -6.526943      2.390560
  C      -3.454951     -7.775170      3.123689
  C      -4.083332     -7.434315      4.474409
  N      -4.718640     -6.136175      4.338883
  Mo     -3.606198     -4.608262      3.597043
  N      -1.810506     -5.336625      4.323640
  C      -0.895628     -6.117487      3.494346
  C      -1.581827     -6.452299      2.189211
  H      -0.607481     -7.031348      4.039375
  H       0.027593     -5.549591      3.292661
  H      -1.226208     -7.412168      1.783052
  H      -1.373532     -5.678181      1.446494
  H      -4.808003     -8.211907      4.749399
  H      -3.320751     -7.395072      5.268184
  H      -4.176267     -8.319172      2.501469
  H      -2.574260     -8.417104      3.253468
  H      -2.587865     -5.046544     -0.135743
  H      -4.315181     -4.703348     -0.095541
  H      -3.242557     -7.218952      0.408941
  H      -4.771947     -6.696207      1.148302
  C      -2.613923     -2.953042      1.309103
  C      -2.314177     -2.512851     -0.001345
  C      -1.771204     -1.253728     -0.192409
  C      -1.538435     -0.388602      0.896864
  C      -1.811758     -0.803905      2.185803
  C      -2.296129     -2.108767      2.409717
  N      -2.616523     -2.618112      3.650144
  C      -2.083936     -2.070073      4.755860
  C      -0.733103     -1.608766      4.975343
  O      -0.356131     -0.958567      5.918835
  Cl      0.521503     -2.322744      3.830738
  C      -5.957252     -5.872115      4.836350
  C      -6.758310     -6.757773      5.594877
  C      -8.029830     -6.374379      5.984427
  C      -8.543958     -5.111937      5.629274
  C      -7.764635     -4.213472      4.920217
  C      -6.451555     -4.562743      4.550804
  N      -5.584062     -3.734565      3.830963
  C      -5.883919     -2.429190      3.761745
  C      -5.463648     -1.581107      2.675380
  O      -5.111531     -1.898515      1.564172
  Cl     -5.591258      0.167907      3.136275
  C      -1.440926     -5.147772      5.612244
  C      -0.179099     -5.509312      6.158698
  C       0.120637     -5.181534      7.463515
  C      -0.803083     -4.469620      8.267836
  C      -2.043467     -4.137041      7.773352
  C      -2.405522     -4.517228      6.458613
  N      -3.601623     -4.205781      5.865255
  C      -4.668336     -3.837384      6.581996
  C      -5.048201     -4.424472      7.854559
  O      -4.594144     -5.381403      8.431033
  Cl     -6.521295     -3.570218      8.503572
  H      -2.549856     -3.128145     -0.866935
  H      -1.564493     -0.910304     -1.206713
  H      -1.166611      0.620620      0.719685
  H      -1.684062     -0.125788      3.029055
  H      -2.680681     -2.070961      5.665655
  H      -6.377754     -7.736230      5.883366
  H      -8.642038     -7.063327      6.567204
  H      -9.560462     -4.839057      5.912565
  H      -8.178853     -3.248746      4.630245
  H      -6.559081     -1.981524      4.494933
  H       0.572107     -5.994662      5.539387
  H       1.103472     -5.429512      7.866124
  H      -0.517879     -4.156159      9.272014
  H      -2.733684     -3.545930      8.372162
  H      -5.378019     -3.146055      6.144180
  N      -6.163474     -5.296357      1.719099
  N      -6.902887     -5.578806      0.855560
  H      -6.547560     -5.953850     -0.085185
74
Coordinates from ORCA-job orca E -7352.984225646464
  N      -3.221364     -4.130610      1.644501
  C      -3.474868     -5.047434      0.528935
  C      -3.706622     -6.452210      1.065806
  N      -3.057990     -6.524197      2.399796
  C      -3.454486     -7.775063      3.128969
  C      -4.082329     -7.434771      4.479292
  N      -4.718617     -6.137960      4.337614
  Mo     -3.596195     -4.611131      3.603413
  N      -1.801802     -5.340912      4.332621
  C      -0.890875     -6.126736      3.503997
  C      -1.578341     -6.453381      2.197205
  H      -0.609381     -7.043584      4.047642
  H       0.036432     -5.565039      3.303687
  H      -1.225977     -7.411801      1.785089
  H      -1.369741     -5.674927      1.458739
  H      -4.806840     -8.212710      4.754180
  H      -3.320843     -7.392852      5.273896
  H      -4.179280     -8.312751      2.505525
  H      -2.575846     -8.420483      3.254469
  H      -2.594486     -5.039246     -0.131794
  H      -4.323902     -4.701683     -0.080991
  H      -3.235759     -7.209342      0.415579
  H      -4.767647     -6.700104      1.145923
  C      -2.617592     -2.948037      1.315843
  C      -2.325975     -2.504109      0.004782
  C      -1.781813     -1.245549     -0.185563
  C      -1.539183     -0.385152      0.905433
  C      -1.804741     -0.804070      2.194923
  C      -2.291429     -2.108202      2.417223
  N      -2.604484     -2.622202      3.657247
  C      -2.066827     -2.074403      4.760017
  C      -0.718790     -1.597877      4.962494
  O      -0.337099     -0.932087      5.893040
  Cl      0.520286     -2.265531      3.774633
  C      -5.956122     -5.871379      4.833716
  C      -6.760986     -6.752998      5.592997
  C      -8.032678     -6.364734      5.976818
  C      -8.542710     -5.102488      5.614582
  C      -7.759435     -4.208312      4.904340
  C      -6.446152     -4.562557      4.541172
  N      -5.572057     -3.741144      3.822891
  C      -5.870286     -2.434079      3.752894
  C      -5.465506     -1.586655      2.660881
  O      -5.145844     -1.902998      1.539614
  Cl     -5.580798      0.162291      3.125999
  C      -1.433282     -5.149896      5.620882
  C      -0.172614     -5.511449      6.169589
  C       0.125260     -5.181475      7.474240
  C      -0.799493     -4.467854      8.276003
  C      -2.039294     -4.136030      7.779493
  C      -2.399473     -4.518308      6.464890
  N      -3.595710     -4.210040      5.869788
  C      -4.666192     -3.848844      6.584886
  C      -5.045638     -4.440576      7.855198
  O      -4.586126     -5.395081      8.431580
  Cl     -6.529924     -3.601814      8.498321
  H      -2.568583     -3.117149     -0.860483
  H      -1.580825     -0.898775     -1.199838
  H      -1.165654      0.623619      0.729368
  H      -1.669101     -0.129084      3.039515
  H      -2.653277     -2.084686      5.676377
  H      -6.382971     -7.731148      5.885926
  H      -8.648644     -7.049591      6.560411
  H      -9.559666     -4.826520      5.893162
  H      -8.170741     -3.244065      4.608600
  H      -6.539471     -1.986288      4.491540
  H       0.578522     -5.998866      5.551759
  H       1.107293     -5.429210      7.878885
  H      -0.515587     -4.152922      9.280062
  H      -2.730901     -3.544469      8.376289
  H      -5.380257     -3.163141      6.145289
  N      -6.236440     -5.308149      1.696749
  N      -6.960338     -5.599507      0.823348
  H      -6.584740     -5.971049     -0.110475
74
Coordinates from ORCA-job orca E -7352.986685132351
  N      -3.222239     -4.126017      1.650826
  C      -3.480278     -5.042514      0.536903
  C      -3.704049     -6.447518      1.076110
  N      -3.053472     -6.521258      2.408212
  C      -3.451628     -7.774258      3.134933
  C      -4.078982     -7.433567      4.484934
  N      -4.716980     -6.138457      4.336351
  Mo     -3.584770     -4.613274      3.609281
  N      -1.791644     -5.343697      4.339988
  C      -0.884738     -6.134637      3.511795
  C      -1.573607     -6.453266      2.203401
  H      -0.609970     -7.054360      4.054196
  H       0.046722     -5.579352      3.312749
  H      -1.223916     -7.409951      1.785237
  H      -1.365527     -5.670237      1.469292
  H      -4.802406     -8.212191      4.761154
  H      -3.318049     -7.387532      5.279767
  H      -4.179309     -8.306994      2.510783
  H      -2.574582     -8.422375      3.257038
  H      -2.605692     -5.030642     -0.131299
  H      -4.337149     -4.699129     -0.063254
  H      -3.231038     -7.199686      0.421274
  H      -4.764450     -6.703584      1.146819
  C      -2.624033     -2.941235      1.320874
  C      -2.344972     -2.492542      0.008633
  C      -1.806827     -1.231653     -0.182263
  C      -1.558713     -0.373844      0.909624
  C      -1.811917     -0.797582      2.200090
  C      -2.291015     -2.104468      2.422424
  N      -2.592203     -2.625146      3.662935
  C      -2.051579     -2.078476      4.764816
  C      -0.703317     -1.600470      4.964014
  O      -0.320274     -0.938220      5.896465
  Cl      0.537937     -2.295061      3.794447
  C      -5.954108     -5.869366      4.830000
  C      -6.762789     -6.746720      5.590244
  C      -8.035207     -6.354101      5.966989
  C      -8.541830     -5.092885      5.595863
  C      -7.754809     -4.203150      4.884024
  C      -6.440702     -4.561599      4.528615
  N      -5.559944     -3.747122      3.811633
  C      -5.854988     -2.438389      3.737011
  C      -5.454073     -1.595798      2.640302
  O      -5.144714     -1.916387      1.517273
  Cl     -5.544442      0.154758      3.106077
  C      -1.423684     -5.149590      5.627795
  C      -0.163752     -5.510098      6.178482
  C       0.132247     -5.177399      7.482904
  C      -0.793933     -4.462541      8.282021
  C      -2.033491     -4.132256      7.783651
  C      -2.391805     -4.517140      6.469364
  N      -3.588430     -4.212745      5.872253
  C      -4.662340     -3.857466      6.585755
  C      -5.040844     -4.451705      7.854930
  O      -4.575118     -5.402190      8.433247
  Cl     -6.533152     -3.624247      8.493858
  H      -2.593514     -3.104435     -0.855786
  H      -1.615391     -0.880631     -1.196919
  H      -1.190392      0.636874      0.733724
  H      -1.671999     -0.124180      3.045196
  H      -2.634572     -2.092392      5.683229
  H      -6.386810     -7.723960      5.888915
  H      -8.654877     -7.034625      6.551733
  H      -9.559673     -4.814373      5.868663
  H      -8.163782     -3.240138      4.580970
  H      -6.520672     -1.986891      4.476636
  H       0.587450     -5.999462      5.562142
  H       1.113638     -5.424269      7.889635
  H      -0.511407     -4.145892      9.285939
  H      -2.726691     -3.540677      8.378654
  H      -5.380202     -3.177048      6.144015
  N      -6.309422     -5.322881      1.677408
  N      -7.020197     -5.624381      0.796651
  H      -6.625760     -5.992878     -0.130218
74
Coordinates from ORCA-job orca E -7352.988735871396
  N      -3.222212     -4.121001      1.658745
  C      -3.487937     -5.035601      0.545745
  C      -3.703418     -6.441694      1.085757
  N      -3.049350     -6.518405      2.415518
  C      -3.448604     -7.773425      3.139853
  C      -4.075476     -7.432445      4.489697
  N      -4.715295     -6.138930      4.334944
  Mo     -3.573700     -4.615320      3.616327
  N      -1.782598     -5.347139      4.347182
  C      -0.879708     -6.142734      3.518882
  C      -1.569502     -6.452259      2.208407
  H      -0.612318     -7.065772      4.059507
  H       0.056151     -5.594112      3.322062
  H      -1.221760     -7.406623      1.783527
  H      -1.362206     -5.663881      1.479511
  H      -4.797261     -8.212016      4.767789
  H      -3.314638     -7.382107      5.284296
  H      -4.178544     -8.301994      2.514949
  H      -2.572878     -8.423765      3.259104
  H      -2.621072     -5.019785     -0.132183
  H      -4.354269     -4.693167     -0.041327
  H      -3.229570     -7.188957      0.425586
  H      -4.763104     -6.705065      1.150305
  C      -2.627907     -2.934625      1.327970
  C      -2.358695     -2.481522      0.015167
  C      -1.823352     -1.219459     -0.175309
  C      -1.569107     -0.364933      0.917735
  C      -1.813175     -0.792884      2.208687
  C      -2.288840     -2.101143      2.430071
  N      -2.580535     -2.628157      3.670614
  C      -2.035828     -2.083899      4.771548
  C      -0.688366     -1.600090      4.963650
  O      -0.303601     -0.932192      5.891247
  Cl      0.548262     -2.286851      3.784812
  C      -5.952588     -5.868209      4.825787
  C      -6.764568     -6.742242      5.586372
  C      -8.038063     -6.346572      5.956024
  C      -8.542258     -5.086746      5.576428
  C      -7.752164     -4.200582      4.863420
  C      -6.436754     -4.561732      4.515857
  N      -5.550496     -3.753315      3.799734
  C      -5.843096     -2.443293      3.719199
  C      -5.445190     -1.607866      2.616349
  O      -5.145952     -1.935372      1.492420
  Cl     -5.521048      0.145541      3.075415
  C      -1.415136     -5.151001      5.634785
  C      -0.156124     -5.511077      6.187290
  C       0.137828     -5.176724      7.491846
  C      -0.789907     -4.461316      8.288710
  C      -2.029073     -4.131850      7.788493
  C      -2.385061     -4.517816      6.474035
  N      -3.581600     -4.216083      5.874729
  C      -4.657518     -3.864272      6.587560
  C      -5.033301     -4.458189      7.857305
  O      -4.560861     -5.403461      8.438995
  Cl     -6.528421     -3.635691      8.496265
  H      -2.612814     -3.091536     -0.848979
  H      -1.638971     -0.864720     -1.189970
  H      -1.203110      0.646764      0.742607
  H      -1.668410     -0.121555      3.054577
  H      -2.613112     -2.103821      5.693418
  H      -6.389929     -7.718338      5.890512
  H      -8.660919     -7.023456      6.541607
  H      -9.561218     -4.806688      5.843457
  H      -8.159615     -3.239193      4.553224
  H      -6.505812     -1.987070      4.458637
  H       0.595179     -6.002016      5.572189
  H       1.118398     -5.423250      7.900748
  H      -0.509018     -4.144061      9.292909
  H      -2.723983     -3.540928      8.382332
  H      -5.377985     -3.187542      6.144487
  N      -6.383133     -5.338721      1.661502
  N      -7.082941     -5.651106      0.775571
  H      -6.671686     -6.016512     -0.144797
74
Coordinates from ORCA-job orca E -7352.990438720931
  N      -3.218878     -4.115123      1.666113
  C      -3.495530     -5.026582      0.553782
  C      -3.702978     -6.434195      1.093086
  N      -3.044591     -6.514715      2.420063
  C      -3.444570     -7.771299      3.142193
  C      -4.070396     -7.429926      4.492057
  N      -4.711943     -6.137794      4.332589
  Mo     -3.562240     -4.615578      3.622623
  N      -1.773985     -5.349123      4.352681
  C      -0.874854     -6.149090      3.524069
  C      -1.565008     -6.449482      2.211100
  H      -0.615224     -7.075499      4.062850
  H       0.065489     -5.607194      3.330172
  H      -1.218311     -7.401180      1.779517
  H      -1.358669     -5.655501      1.487768
  H      -4.790118     -8.210423      4.773027
  H      -3.308670     -7.375411      5.285457
  H      -4.176264     -8.296612      2.516735
  H      -2.569931     -8.423440      3.259169
  H      -2.638016     -5.007281     -0.135463
  H      -4.372324     -4.683598     -0.017511
  H      -3.229528     -7.176865      0.427494
  H      -4.761515     -6.703370      1.154876
  C      -2.625165     -2.928805      1.334767
  C      -2.361811     -2.472782      0.021833
  C      -1.826386     -1.210693     -0.167841
  C      -1.567144     -0.358999      0.926185
  C      -1.805901     -0.789784      2.217298
  C      -2.281096     -2.098232      2.437391
  N      -2.567256     -2.629648      3.677563
  C      -2.018716     -2.088183      4.777632
  C      -0.670933     -1.602822      4.964893
  O      -0.283345     -0.937035      5.892634
  Cl      0.563437     -2.302319      3.791483
  C      -5.948188     -5.865721      4.823940
  C      -6.760491     -6.736744      5.587508
  C      -8.033305     -6.338022      5.956119
  C      -8.536207     -5.079087      5.571620
  C      -7.745874     -4.196461      4.854445
  C      -6.430926     -4.560408      4.508305
  N      -5.543833     -3.757663      3.788162
  C      -5.838712     -2.447530      3.703093
  C      -5.461191     -1.619140      2.588348
  O      -5.191314     -1.953199      1.458850
  Cl     -5.535540      0.137562      3.036102
  C      -1.407488     -5.151192      5.640339
  C      -0.149342     -5.510727      6.194525
  C       0.142818     -5.174270      7.498957
  C      -0.786143     -4.457534      8.293147
  C      -2.025029     -4.129050      7.791292
  C      -2.379539     -4.517305      6.477206
  N      -3.576110     -4.218492      5.874963
  C      -4.656385     -3.870337      6.584117
  C      -5.037448     -4.467031      7.850492
  O      -4.568079     -5.414219      8.431746
  Cl     -6.547810     -3.659935      8.473474
  H      -2.620671     -3.080659     -0.842381
  H      -1.645947     -0.853498     -1.182320
  H      -1.201172      0.652834      0.751935
  H      -1.657005     -0.120295      3.063906
  H      -2.591948     -2.111065      5.701878
  H      -6.386136     -7.711890      5.895049
  H      -8.656852     -7.011507      6.544846
  H      -9.554875     -4.797214      5.837830
  H      -8.152690     -3.236261      4.539703
  H      -6.494498     -1.988945      4.447155
  H       0.602038     -6.003264      5.580710
  H       1.122647     -5.420186      7.909925
  H      -0.506515     -4.138813      9.297224
  H      -2.720591     -3.537750      8.383783
  H      -5.378222     -3.198027      6.136168
  N      -6.454160     -5.354010      1.647151
  N      -7.145373     -5.677600      0.759105
  H      -6.720368     -6.040333     -0.155277
74
Coordinates from ORCA-job orca E -7352.991881401104
  N      -3.216721     -4.110121      1.675658
  C      -3.505819     -5.018234      0.563792
  C      -3.703947     -6.428551      1.101803
  N      -3.039903     -6.513280      2.425546
  C      -3.440300     -7.771066      3.146167
  C      -4.066625     -7.429134      4.495738
  N      -4.709362     -6.137958      4.331444
  Mo     -3.551499     -4.617521      3.630858
  N      -1.766261     -5.352627      4.358634
  C      -0.870500     -6.156341      3.529536
  C      -1.560789     -6.448072      2.214356
  H      -0.618485     -7.086022      4.066481
  H       0.074093     -5.620848      3.338789
  H      -1.214294     -7.396881      1.776279
  H      -1.355850     -5.648516      1.496547
  H      -4.784720     -8.210398      4.778774
  H      -3.304827     -7.370832      5.288765
  H      -4.172788     -8.294236      2.519895
  H      -2.566552     -8.424554      3.262201
  H      -2.659233     -4.994747     -0.138390
  H      -4.394112     -4.674694      0.010654
  H      -3.231572     -7.167109      0.430550
  H      -4.762225     -6.703241      1.163932
  C      -2.628281     -2.921311      1.343641
  C      -2.374775     -2.459573      0.030807
  C      -1.842785     -1.195685     -0.157351
  C      -1.578201     -0.347748      0.938226
  C      -1.808419     -0.783756      2.229342
  C      -2.280304     -2.093658      2.447146
  N      -2.556953     -2.631664      3.687011
  C      -2.002606     -2.093205      4.785276
  C      -0.656297     -1.599236      4.962301
  O      -0.265721     -0.926468      5.883659
  Cl      0.569545     -2.276928      3.767328
  C      -5.947080     -5.865223      4.818602
  C      -6.762185     -6.734276      5.581326
  C      -8.036879     -6.334652      5.942375
  C      -8.538885     -5.077621      5.550063
  C      -7.746271     -4.197247      4.832622
  C      -6.429198     -4.561542      4.494659
  N      -5.538652     -3.763163      3.774892
  C      -5.831629     -2.452694      3.678931
  C      -5.445933     -1.635790      2.558471
  O      -5.155683     -1.982683      1.437683
  Cl     -5.499397      0.125245      2.993359
  C      -1.400416     -5.154336      5.646659
  C      -0.143368     -5.514370      6.202244
  C       0.146676     -5.178291      7.507396
  C      -0.783989     -4.462295      8.300182
  C      -2.022357     -4.133584      7.796655
  C      -2.374226     -4.520474      6.481612
  N      -3.570216     -4.222416      5.876708
  C      -4.651523     -3.873807      6.584984
  C      -5.029954     -4.465797      7.853864
  O      -4.551835     -5.403117      8.444249
  Cl     -6.530125     -3.646203      8.486269
  H      -2.638175     -3.064539     -0.834093
  H      -1.669093     -0.834320     -1.171554
  H      -1.214893      0.665340      0.765555
  H      -1.655320     -0.116985      3.077413
  H      -2.567879     -2.123044      5.714182
  H      -6.388380     -7.707971      5.894213
  H      -8.662878     -7.005772      6.531241
  H      -9.559059     -4.795640      5.810464
  H      -8.152600     -3.239011      4.511233
  H      -6.488276     -1.986274      4.417361
  H       0.608220     -6.007601      5.589093
  H       1.125584     -5.424602      7.920356
  H      -0.506314     -4.144681      9.305191
  H      -2.719425     -3.543894      8.389163
  H      -5.373585     -3.202906      6.135313
  N      -6.524944     -5.373248      1.638493
  N      -7.209875     -5.709758      0.749351
  H      -6.773741     -6.070112     -0.160756
74
Coordinates from ORCA-job orca E -7352.993151899074
  N      -3.210073     -4.104597      1.683586
  C      -3.514638     -5.007676      0.572436
  C      -3.703989     -6.420499      1.107813
  N      -3.034473     -6.510109      2.428125
  C      -3.435000     -7.768902      3.147024
  C      -4.061753     -7.426891      4.496194
  N      -4.705213     -6.136384      4.328538
  Mo     -3.540508     -4.617137      3.637214
  N      -1.758799     -5.354351      4.362535
  C      -0.866016     -6.161256      3.532792
  C      -1.556042     -6.444331      2.215248
  H      -0.621709     -7.094228      4.067714
  H       0.082746     -5.632024      3.345647
  H      -1.209130     -7.389975      1.770670
  H      -1.352618     -5.639116      1.503149
  H      -4.778448     -8.208739      4.781099
  H      -3.299647     -7.365706      5.288674
  H      -4.167737     -8.290650      2.519929
  H      -2.561822     -8.423225      3.262509
  H      -2.679966     -4.980637     -0.143373
  H      -4.414083     -4.661816      0.038956
  H      -3.233211     -7.154948      0.431059
  H      -4.761294     -6.699358      1.172304
  C      -2.622205     -2.915812      1.351292
  C      -2.373031     -2.451335      0.038710
  C      -1.842214     -1.186767     -0.148415
  C      -1.576021     -0.340479      0.947925
  C      -1.802864     -0.778960      2.238933
  C      -2.272497     -2.089755      2.455428
  N      -2.545083     -2.631470      3.695008
  C      -1.987528     -2.097018      4.793068
  C      -0.640380     -1.603560      4.968306
  O      -0.248663     -0.930340      5.888662
  Cl      0.584979     -2.290589      3.778214
  C      -5.942897     -5.863233      4.814914
  C      -6.757887     -6.730652      5.579497
  C      -8.032581     -6.330030      5.939221
  C      -8.534748     -5.074275      5.542806
  C      -7.742653     -4.196128      4.822190
  C      -6.425149     -4.560922      4.485857
  N      -5.535473     -3.766772      3.761591
  C      -5.830739     -2.456920      3.657627
  C      -5.457904     -1.650024      2.525880
  O      -5.191499     -2.006357      1.402033
  Cl     -5.537258      0.115826      2.937418
  C      -1.393882     -5.156450      5.651147
  C      -0.138000     -5.517452      6.208011
  C       0.150136     -5.182207      7.513899
  C      -0.781904     -4.466699      8.305361
  C      -2.019608     -4.137169      7.800226
  C      -2.369114     -4.522458      6.484289
  N      -3.564002     -4.223903      5.876621
  C      -4.646030     -3.872484      6.583192
  C      -5.025242     -4.459927      7.853349
  O      -4.549437     -5.397042      8.446068
  Cl     -6.528853     -3.641018      8.479483
  H      -2.639134     -3.054342     -0.826727
  H      -1.671467     -0.823430     -1.162397
  H      -1.214289      0.673314      0.776178
  H      -1.648869     -0.113181      3.087561
  H      -2.550048     -2.129569      5.723572
  H      -6.383691     -7.703182      5.895511
  H      -8.658507     -6.999095      6.530473
  H      -9.554956     -4.791772      5.802490
  H      -8.149419     -3.239394      4.497026
  H      -6.483205     -1.985931      4.396868
  H       0.613655     -6.011400      5.595444
  H       1.128023     -5.429392      7.928696
  H      -0.506116     -4.150465      9.311322
  H      -2.717726     -3.548774      8.392866
  H      -5.366682     -3.202101      6.130676
  N      -6.593003     -5.390690      1.628498
  N      -7.272898     -5.740393      0.741067
  H      -6.828860     -6.098839     -0.165356
74
Coordinates from ORCA-job orca E -7352.994192668423
  N      -3.202453     -4.099300      1.691320
  C      -3.523874     -4.996437      0.580785
  C      -3.704181     -6.412505      1.112318
  N      -3.029065     -6.507666      2.429186
  C      -3.429606     -7.767377      3.146215
  C      -4.057528     -7.425895      4.494960
  N      -4.700964     -6.135373      4.325846
  Mo     -3.530639     -4.617183      3.643040
  N      -1.752543     -5.355708      4.365522
  C      -0.861882     -6.165163      3.535248
  C      -1.551277     -6.440697      2.215333
  H      -0.624665     -7.101057      4.068376
  H       0.090562     -5.641442      3.351786
  H      -1.203203     -7.383179      1.764883
  H      -1.349332     -5.630275      1.508604
  H      -4.773421     -8.208047      4.780933
  H      -3.295168     -7.363287      5.287075
  H      -4.161689     -8.288619      2.517954
  H      -2.556620     -8.421911      3.261911
  H      -2.702012     -4.965554     -0.149237
  H      -4.434143     -4.647345      0.068148
  H      -3.235328     -7.143011      0.430083
  H      -4.760550     -6.694742      1.181631
  C      -2.615535     -2.910161      1.359412
  C      -2.369702     -2.442348      0.047487
  C      -1.839228     -1.177267     -0.137726
  C      -1.571134     -0.333363      0.959895
  C      -1.795663     -0.774792      2.250458
  C      -2.265072     -2.085894      2.464599
  N      -2.534920     -2.630791      3.703557
  C      -1.972566     -2.100687      4.800585
  C      -0.625499     -1.603994      4.969753
  O      -0.230266     -0.932700      5.889814
  Cl      0.594575     -2.288899      3.773288
  C      -5.937414     -5.860793      4.814586
  C      -6.750203     -6.725693      5.584225
  C      -8.022852     -6.322609      5.948457
  C      -8.525347     -5.067265      5.550893
  C      -7.735888     -4.192363      4.823648
  C      -6.419978     -4.559234      4.482715
  N      -5.534263     -3.770322      3.749464
  C      -5.832542     -2.461905      3.634901
  C      -5.471708     -1.666597      2.491191
  O      -5.200366     -2.035074      1.372308
  Cl     -5.538969      0.103544      2.886643
  C      -1.389111     -5.157928      5.655091
  C      -0.133915     -5.518862      6.212928
  C       0.153176     -5.182648      7.518809
  C      -0.779525     -4.465941      8.308229
  C      -2.017052     -4.136713      7.802027
  C      -2.366166     -4.523788      6.486510
  N      -3.560830     -4.226508      5.875518
  C      -4.647869     -3.874574      6.575591
  C      -5.040313     -4.464566      7.840035
  O      -4.577608     -5.409486      8.430932
  Cl     -6.561563     -3.658704      8.441080
  H      -2.637882     -3.042848     -0.819035
  H      -1.670439     -0.811802     -1.151265
  H      -1.209862      0.680859      0.789764
  H      -1.640210     -0.110814      3.100279
  H      -2.529457     -2.138168      5.734322
  H      -6.375518     -7.697512      5.901866
  H      -8.646793     -6.989132      6.544673
  H      -9.543980     -4.782873      5.814702
  H      -8.143230     -3.236343      4.497045
  H      -6.480545     -1.984939      4.374111
  H       0.617843     -6.013549      5.601016
  H       1.130577     -5.429557      7.934878
  H      -0.504610     -4.148615      9.314096
  H      -2.714529     -3.547354      8.393997
  H      -5.366104     -3.206651      6.115038
  N      -6.658788     -5.409406      1.619722
  N      -7.335499     -5.773497      0.735815
  H      -6.886927     -6.130666     -0.168423
74
Coordinates from ORCA-job orca E -7352.995124295226
  N      -3.193485     -4.094244      1.698732
  C      -3.533075     -4.985275      0.589355
  C      -3.704520     -6.404735      1.116644
  N      -3.023430     -6.505020      2.429748
  C      -3.422867     -7.765491      3.145325
  C      -4.053140     -7.424995      4.493218
  N      -4.696394     -6.134390      4.322881
  Mo     -3.521693     -4.616392      3.648303
  N      -1.746877     -5.356381      4.367143
  C      -0.857749     -6.167313      3.536093
  C      -1.546547     -6.436253      2.214383
  H      -0.626707     -7.105865      4.067364
  H       0.097780     -5.648198      3.356136
  H      -1.196939     -7.375690      1.758659
  H      -1.346449     -5.621182      1.512401
  H      -4.768832     -8.207478      4.778656
  H      -3.291643     -7.361731      5.286131
  H      -4.153195     -8.287620      2.515752
  H      -2.549360     -8.419128      3.262105
  H      -2.724821     -4.950937     -0.155279
  H      -4.453685     -4.632385      0.098187
  H      -3.237977     -7.131617      0.429188
  H      -4.759850     -6.689522      1.192762
  C      -2.607053     -2.904946      1.367215
  C      -2.362874     -2.434568      0.055980
  C      -1.833170     -1.168832     -0.127508
  C      -1.565386     -0.326270      0.971116
  C      -1.789190     -0.769881      2.261160
  C      -2.257594     -2.081531      2.473314
  N      -2.526477     -2.628282      3.711785
  C      -1.960886     -2.101910      4.808148
  C      -0.613698     -1.603425      4.974057
  O      -0.216701     -0.933522      5.894188
  Cl      0.604185     -2.291568      3.777547
  C      -5.933844     -5.860823      4.809521
  C      -6.746004     -6.725886      5.579553
  C      -8.019590     -6.324357      5.941922
  C      -8.523866     -5.070519      5.541601
  C      -7.735556     -4.196033      4.812962
  C      -6.418406     -4.560991      4.473714
  N      -5.535301     -3.774210      3.736509
  C      -5.837754     -2.467575      3.612387
  C      -5.485861     -1.681485      2.459736
  O      -5.220928     -2.058737      1.342133
  Cl     -5.579008      0.092192      2.833738
  C      -1.384841     -5.161532      5.658093
  C      -0.131112     -5.525051      6.216880
  C       0.153935     -5.192867      7.524374
  C      -0.780023     -4.478181      8.313902
  C      -2.016393     -4.146113      7.806240
  C      -2.362904     -4.528133      6.488691
  N      -3.555614     -4.227245      5.874947
  C      -4.642094     -3.867499      6.572544
  C      -5.035457     -4.447277      7.840912
  O      -4.566504     -5.380122      8.446065
  Cl     -6.533491     -3.608978      8.457170
  H      -2.631584     -3.033195     -0.811626
  H      -1.665158     -0.801951     -1.140651
  H      -1.205094      0.688518      0.802387
  H      -1.634100     -0.106999      3.111951
  H      -2.514074     -2.142785      5.743910
  H      -6.370056     -7.696377      5.899719
  H      -8.642666     -6.990654      6.539274
  H      -9.542920     -4.787080      5.804778
  H      -8.144350     -3.241421      4.484130
  H      -6.484345     -1.986464      4.350103
  H       0.620831     -6.019366      5.604852
  H       1.130118     -5.442145      7.941825
  H      -0.507375     -4.164815      9.321627
  H      -2.714669     -3.559005      8.399566
  H      -5.355983     -3.197195      6.108592
  N      -6.723203     -5.429242      1.612196
  N      -7.397755     -5.809239      0.733616
  H      -6.947544     -6.166150     -0.169306
74
Coordinates from ORCA-job orca E -7352.995914557941
  N      -3.184145     -4.089628      1.706311
  C      -3.542885     -4.974965      0.598912
  C      -3.705617     -6.397863      1.122385
  N      -3.017734     -6.503140      2.431492
  C      -3.416158     -7.763973      3.146474
  C      -4.049527     -7.424176      4.493379
  N      -4.691472     -6.132815      4.322468
  Mo     -3.512388     -4.615800      3.653836
  N      -1.740312     -5.356957      4.368635
  C      -0.852716     -6.169325      3.536761
  C      -1.541673     -6.433319      2.213992
  H      -0.626754     -7.109894      4.066741
  H       0.105305     -5.654173      3.359208
  H      -1.191150     -7.370512      1.754227
  H      -1.343129     -5.614894      1.515415
  H      -4.766179     -8.206348      4.777163
  H      -3.289475     -7.361665      5.287783
  H      -4.144156     -8.287868      2.515610
  H      -2.541875     -8.416237      3.265138
  H      -2.749448     -4.937425     -0.161179
  H      -4.473641     -4.618535      0.129825
  H      -3.242383     -7.121697      0.429532
  H      -4.760491     -6.684271      1.207390
  C      -2.600823     -2.898851      1.374987
  C      -2.360728     -2.425123      0.064249
  C      -1.834638     -1.157586     -0.117888
  C      -1.567714     -0.315973      0.981595
  C      -1.788310     -0.762541      2.271236
  C      -2.252389     -2.075997      2.481904
  N      -2.518011     -2.625283      3.720357
  C      -1.948545     -2.103614      4.816188
  C      -0.600852     -1.603987      4.979807
  O      -0.203869     -0.929305      5.896311
  Cl      0.614766     -2.285512      3.777343
  C      -5.929797     -5.858853      4.807051
  C      -6.741694     -6.722793      5.578670
  C      -8.015847     -6.321660      5.939385
  C      -8.521406     -5.069439      5.535271
  C      -7.734080     -4.196598      4.803928
  C      -6.415906     -4.560612      4.466257
  N      -5.534564     -3.777112      3.724522
  C      -5.837817     -2.472047      3.586917
  C      -5.478206     -1.697179      2.429157
  O      -5.202981     -2.085143      1.317549
  Cl     -5.601113      0.079956      2.777806
  C      -1.379286     -5.165202      5.661003
  C      -0.126902     -5.531637      6.220324
  C       0.156693     -5.203582      7.529334
  C      -0.778052     -4.490645      8.319316
  C      -2.013391     -4.155425      7.810654
  C      -2.357777     -4.532220      6.491213
  N      -3.548475     -4.227187      5.875288
  C      -4.634320     -3.858893      6.570126
  C      -5.031251     -4.429775      7.840835
  O      -4.575340     -5.370091      8.444571
  Cl     -6.539226     -3.595673      8.439345
  H      -2.629638     -3.022384     -0.804237
  H      -1.669441     -0.788701     -1.130785
  H      -1.210991      0.700285      0.814046
  H      -1.634330     -0.100455      3.122867
  H      -2.497945     -2.148691      5.753983
  H      -6.365048     -7.691932      5.902155
  H      -8.638223     -6.986920      6.538654
  H      -9.540641     -4.786100      5.797926
  H      -8.144003     -3.243490      4.472235
  H      -6.486485     -1.983320      4.317874
  H       0.624985     -6.025704      5.607941
  H       1.131735     -5.455661      7.947781
  H      -0.507366     -4.181496      9.328902
  H      -2.712253     -3.570547      8.405613
  H      -5.343216     -3.186301      6.101989
  N      -6.786147     -5.449479      1.608053
  N      -7.460354     -5.846711      0.736563
  H      -7.011631     -6.204899     -0.166245
74
Coordinates from ORCA-job orca E -7352.996613472614
  N      -3.174249     -4.084118      1.711492
  C      -3.551634     -4.963046      0.606074
  C      -3.706234     -6.389266      1.124589
  N      -3.012269     -6.499577      2.430047
  C      -3.408628     -7.761425      3.143608
  C      -4.045390     -7.423837      4.489584
  N      -4.686537     -6.131879      4.319944
  Mo     -3.505612     -4.614254      3.656331
  N      -1.735678     -5.355441      4.367916
  C      -0.848310     -6.167824      3.535207
  C      -1.536923     -6.427963      2.211154
  H      -0.625745     -7.110038      4.063741
  H       0.111273     -5.654906      3.360109
  H      -1.185114     -7.363079      1.748054
  H      -1.339779     -5.606735      1.515430
  H      -4.762955     -8.206121      4.770650
  H      -3.286847     -7.363025      5.285582
  H      -4.133215     -8.288062      2.511060
  H      -2.532624     -8.410981      3.264251
  H      -2.772915     -4.922081     -0.168754
  H      -4.491377     -4.602923      0.158086
  H      -3.246252     -7.109511      0.426181
  H      -4.759989     -6.676579      1.219042
  C      -2.589515     -2.893985      1.381325
  C      -2.346611     -2.419485      0.071412
  C      -1.819720     -1.152023     -0.108947
  C      -1.555483     -0.310741      0.991396
  C      -1.779091     -0.757981      2.280328
  C      -2.243798     -2.071462      2.489303
  N      -2.512647     -2.620489      3.727293
  C      -1.941388     -2.102721      4.823191
  C      -0.593660     -1.601618      4.985793
  O      -0.196526     -0.928293      5.903069
  Cl      0.621390     -2.283899      3.783717
  C      -5.924024     -5.857882      4.806761
  C      -6.732455     -6.720730      5.583212
  C      -8.005157     -6.319484      5.948748
  C      -8.513048     -5.068157      5.544527
  C      -7.729605     -4.197054      4.807334
  C      -6.412539     -4.560933      4.464328
  N      -5.537094     -3.781024      3.713214
  C      -5.845757     -2.478604      3.565373
  C      -5.498988     -1.712838      2.397939
  O      -5.219503     -2.108927      1.290161
  Cl     -5.619088      0.067125      2.733586
  C      -1.376916     -5.167377      5.662100
  C      -0.126022     -5.536537      6.222441
  C       0.155627     -5.212632      7.532975
  C      -0.779822     -4.500853      8.322908
  C      -2.013912     -4.162505      7.812949
  C      -2.356582     -4.535324      6.491954
  N      -3.545443     -4.227221      5.873253
  C      -4.634129     -3.853800      6.561552
  C      -5.041880     -4.420617      7.830213
  O      -4.590712     -5.358180      8.441920
  Cl     -6.545876     -3.573717      8.421703
  H      -2.613773     -3.016003     -0.798108
  H      -1.652082     -0.782985     -1.121369
  H      -1.198505      0.705624      0.825131
  H      -1.626984     -0.096386      3.132701
  H      -2.488461     -2.151464      5.762223
  H      -6.353943     -7.688748      5.907844
  H      -8.624307     -6.983783      6.552400
  H      -9.530959     -4.784384      5.811756
  H      -8.141558     -3.244872      4.475524
  H      -6.491495     -1.985624      4.295966
  H       0.626274     -6.029953      5.610025
  H       1.129511     -5.467238      7.952540
  H      -0.511091     -4.195224      9.334087
  H      -2.712585     -3.578656      8.408809
  H      -5.338286     -3.181514      6.085619
  N      -6.847620     -5.469691      1.599390
  N      -7.521631     -5.884933      0.736758
  H      -7.076376     -6.245096     -0.166287
74
Coordinates from ORCA-job orca E -7352.997203823436
  N      -3.164928     -4.078489      1.717388
  C      -3.560727     -4.951883      0.614675
  C      -3.708166     -6.381155      1.129081
  N      -3.007111     -6.495972      2.430521
  C      -3.400642     -7.758757      3.143592
  C      -4.041351     -7.423453      4.488581
  N      -4.681251     -6.130737      4.320419
  Mo     -3.499035     -4.612622      3.659447
  N      -1.730375     -5.354236      4.367529
  C      -0.843178     -6.165575      3.533167
  C      -1.532619     -6.423262      2.208742
  H      -0.621771     -7.108927      4.060137
  H       0.116886     -5.653302      3.359153
  H      -1.180576     -7.357206      1.743396
  H      -1.336984     -5.600550      1.514316
  H      -4.760680     -8.205602      4.765556
  H      -3.285051     -7.365360      5.286964
  H      -4.121092     -8.289214      2.509449
  H      -2.522293     -8.404627      3.266756
  H      -2.797254     -4.908048     -0.174895
  H      -4.508725     -4.588695      0.186835
  H      -3.252953     -7.098564      0.424906
  H      -4.761136     -6.667991      1.234881
  C      -2.580649     -2.887980      1.388212
  C      -2.336722     -2.411983      0.079019
  C      -1.810051     -1.144186     -0.099611
  C      -1.547324     -0.303707      1.001729
  C      -1.772104     -0.752324      2.289974
  C      -2.236973     -2.066023      2.497248
  N      -2.507672     -2.615079      3.734900
  C      -1.933896     -2.100977      4.830401
  C      -0.586595     -1.596823      4.990463
  O      -0.188740     -0.925822      5.909016
  Cl      0.626972     -2.277678      3.786773
  C      -5.919305     -5.857230      4.806191
  C      -6.726097     -6.719468      5.585044
  C      -7.999329     -6.319547      5.950070
  C      -8.509671     -5.070148      5.542756
  C      -7.728297     -4.200079      4.802418
  C      -6.410537     -4.562327      4.459630
  N      -5.538019     -3.784976      3.703275
  C      -5.850391     -2.485083      3.543007
  C      -5.503678     -1.728672      2.369603
  O      -5.218865     -2.132862      1.265979
  Cl     -5.643196      0.053572      2.686193
  C      -1.373361     -5.171225      5.663425
  C      -0.123980     -5.544515      6.223994
  C       0.156693     -5.225760      7.536064
  C      -0.778267     -4.514573      8.326844
  C      -2.010967     -4.171541      7.816338
  C      -2.353054     -4.539567      6.493835
  N      -3.539936     -4.226413      5.873469
  C      -4.629390     -3.844636      6.556489
  C      -5.046899     -4.404490      7.824749
  O      -4.605410     -5.343430      8.441575
  Cl     -6.545830     -3.542997      8.408519
  H      -2.602355     -3.007887     -0.791367
  H      -1.641129     -0.774424     -1.111558
  H      -1.190648      0.712980      0.836798
  H      -1.620935     -0.091634      3.143272
  H      -2.477604     -2.154219      5.771182
  H      -6.345725     -7.685782      5.912615
  H      -8.616780     -6.983318      6.556051
  H      -9.527681     -4.787092      5.810362
  H      -8.142201     -3.249475      4.468549
  H      -6.497765     -1.986722      4.268479
  H       0.628141     -6.037399      5.610908
  H       1.129424     -5.484072      7.956033
  H      -0.510662     -4.213274      9.339630
  H      -2.708664     -3.588263      8.413599
  H      -5.326917     -3.169707      6.074395
  N      -6.908129     -5.488832      1.593845
  N      -7.583691     -5.923701      0.742262
  H      -7.144974     -6.287970     -0.161821
74
Coordinates from ORCA-job orca E -7352.997708707742
  N      -3.155741     -4.072838      1.721214
  C      -3.568330     -4.941557      0.621687
  C      -3.710384     -6.373111      1.133083
  N      -3.002010     -6.491472      2.430465
  C      -3.391828     -7.755346      3.143561
  C      -4.036446     -7.422517      4.487587
  N      -4.675407     -6.129325      4.321115
  Mo     -3.493508     -4.610321      3.660297
  N      -1.725104     -5.351801      4.366030
  C      -0.837421     -6.160703      3.529505
  C      -1.528343     -6.417721      2.205191
  H      -0.614529     -7.104596      4.054792
  H       0.121849     -5.646967      3.355541
  H      -1.176534     -7.351259      1.738833
  H      -1.334460     -5.594717      1.510606
  H      -4.757585     -8.204612      4.760114
  H      -3.282413     -7.367381      5.288352
  H      -4.107518     -8.290512      2.507918
  H      -2.510442     -8.396481      3.269472
  H      -2.819194     -4.895712     -0.181322
  H      -4.523339     -4.575877      0.211458
  H      -3.261311     -7.088661      0.423426
  H      -4.762543     -6.657752      1.251311
  C      -2.570521     -2.882725      1.392888
  C      -2.323883     -2.406800      0.084183
  C      -1.797871     -1.138657     -0.093508
  C      -1.539111     -0.297429      1.008221
  C      -1.766484     -0.746083      2.295950
  C      -2.229942     -2.060465      2.502664
  N      -2.503757     -2.608784      3.740278
  C      -1.930235     -2.097587      4.836571
  C      -0.582680     -1.593682      4.999431
  O      -0.188490     -0.917289      5.915545
  Cl      0.634052     -2.274609      3.799502
  C      -5.913761     -5.856220      4.806307
  C      -6.718470     -6.717399      5.588458
  C      -7.991874     -6.318301      5.953739
  C      -8.504586     -5.070832      5.543373
  C      -7.725557     -4.202147      4.799082
  C      -6.407675     -4.563443      4.455554
  N      -5.538194     -3.789029      3.693190
  C      -5.855130     -2.491696      3.522144
  C      -5.512564     -1.742795      2.342769
  O      -5.223515     -2.152982      1.242379
  Cl     -5.658366      0.041365      2.646973
  C      -1.370551     -5.174598      5.663787
  C      -0.123236     -5.552637      6.225531
  C       0.154701     -5.241397      7.540088
  C      -0.781179     -4.533271      8.332351
  C      -2.011885     -4.184834      7.820451
  C      -2.350832     -4.544189      6.494821
  N      -3.534776     -4.224632      5.872807
  C      -4.624624     -3.835984      6.551186
  C      -5.046355     -4.386166      7.821928
  O      -4.609711     -5.323457      8.444798
  Cl     -6.544480     -3.517190      8.396818
  H      -2.586815     -3.003384     -0.786558
  H      -1.626723     -0.769036     -1.105131
  H      -1.183658      0.719780      0.843892
  H      -1.618559     -0.084922      3.149431
  H      -2.474353     -2.152938      5.776948
  H      -6.335933     -7.681798      5.919181
  H      -8.607383     -6.981086      6.562775
  H      -9.522447     -4.788166      5.811926
  H      -8.141379     -3.253107      4.463179
  H      -6.503675     -1.989533      4.243908
  H       0.629558     -6.043970      5.612020
  H       1.125700     -5.504275      7.961225
  H      -0.516302     -4.238996      9.347923
  H      -2.710467     -3.604609      8.419708
  H      -5.318057     -3.160751      6.063282
  N      -6.966385     -5.505765      1.586129
  N      -7.644796     -5.961520      0.748142
  H      -7.215089     -6.332310     -0.157053
74
Coordinates from ORCA-job orca E -7352.998140206085
  N      -3.148910     -4.067363      1.725337
  C      -3.575951     -4.932333      0.628957
  C      -3.714454     -6.365443      1.138711
  N      -2.997855     -6.487002      2.431609
  C      -3.383189     -7.752373      3.144868
  C      -4.031482     -7.422547      4.488167
  N      -4.669761     -6.129110      4.323555
  Mo     -3.489215     -4.608916      3.661276
  N      -1.720420     -5.350570      4.365514
  C      -0.831761     -6.155256      3.525844
  C      -1.524975     -6.412457      2.202043
  H      -0.604749     -7.099393      4.048808
  H       0.125453     -5.637955      3.351009
  H      -1.173964     -7.346076      1.735264
  H      -1.333086     -5.589836      1.506476
  H      -4.754338     -8.204769      4.755971
  H      -3.279629     -7.370576      5.291219
  H      -4.093885     -8.292455      2.507713
  H      -2.498313     -8.388132      3.273224
  H      -2.839662     -4.885306     -0.185736
  H      -4.536727     -4.564799      0.233577
  H      -3.273522     -7.080487      0.423689
  H      -4.766195     -6.645904      1.270417
  C      -2.562817     -2.877529      1.397979
  C      -2.313676     -2.401401      0.089822
  C      -1.786291     -1.133712     -0.086549
  C      -1.528582     -0.293152      1.016020
  C      -1.758373     -0.742137      2.303205
  C      -2.223950     -2.055983      2.508786
  N      -2.500620     -2.603892      3.746090
  C      -1.925562     -2.095425      4.842341
  C      -0.578949     -1.587800      5.003041
  O      -0.184290     -0.914714      5.921368
  Cl      0.636938     -2.267499      3.802284
  C      -5.909142     -5.856865      4.806457
  C      -6.712653     -6.717201      5.590728
  C      -7.987113     -6.319393      5.953804
  C      -8.501943     -5.074238      5.539149
  C      -7.724262     -4.206562      4.792198
  C      -6.405615     -4.566531      4.450362
  N      -5.536749     -3.794028      3.685169
  C      -5.856426     -2.498260      3.506447
  C      -5.509395     -1.752336      2.326514
  O      -5.214420     -2.164381      1.228386
  Cl     -5.671631      0.032099      2.622161
  C      -1.368035     -5.178322      5.664573
  C      -0.121899     -5.559733      6.226588
  C       0.155566     -5.252027      7.542060
  C      -0.779192     -4.543150      8.334806
  C      -2.008747     -4.190915      7.822679
  C      -2.348280     -4.547904      6.496435
  N      -3.530693     -4.224074      5.873537
  C      -4.622333     -3.829488      6.545443
  C      -5.056267     -4.374863      7.814152
  O      -4.629350     -5.313131      8.442410
  Cl     -6.549165     -3.491544      8.380531
  H      -2.574921     -2.998193     -0.781304
  H      -1.612537     -0.763945     -1.097675
  H      -1.171871      0.723778      0.852665
  H      -1.610784     -0.081616      3.157283
  H      -2.466984     -2.155391      5.784090
  H      -6.327964     -7.679470      5.925239
  H      -8.601647     -6.981304      6.564794
  H      -9.520341     -4.792450      5.806593
  H      -8.141860     -3.259375      4.453354
  H      -6.508694     -1.994118      4.223459
  H       0.630882     -6.050525      5.612591
  H       1.125750     -5.517775      7.963306
  H      -0.514506     -4.251360      9.351155
  H      -2.705690     -3.609687      8.422414
  H      -5.309999     -3.153329      6.050573
  N      -7.023869     -5.519605      1.578802
  N      -7.706951     -5.997126      0.756966
  H      -7.288355     -6.376930     -0.149369
74
Coordinates from ORCA-job orca E -7352.998514857011
  N      -3.143610     -4.062306      1.727222
  C      -3.582054     -4.925234      0.634223
  C      -3.719479     -6.358452      1.145010
  N      -2.993961     -6.481459      2.432914
  C      -3.373470     -7.748419      3.147023
  C      -4.024783     -7.421310      4.489647
  N      -4.663453     -6.128358      4.326004
  Mo     -3.486156     -4.606323      3.660401
  N      -1.716070     -5.347715      4.364394
  C      -0.825868     -6.146584      3.520914
  C      -1.521979     -6.405547      2.198183
  H      -0.592231     -7.090469      4.041277
  H       0.128047     -5.623751      3.344299
  H      -1.171656     -7.339607      1.731833
  H      -1.332829     -5.583955      1.500705
  H      -4.748479     -8.204068      4.753798
  H      -3.274646     -7.371264      5.294440
  H      -4.079188     -8.293917      2.508891
  H      -2.484597     -8.378074      3.277479
  H      -2.855697     -4.879081     -0.189335
  H      -4.546804     -4.556288      0.249523
  H      -3.288621     -7.075135      0.425771
  H      -4.771023     -6.632468      1.290975
  C      -2.554391     -2.874142      1.399925
  C      -2.301147     -2.400011      0.091870
  C      -1.771822     -1.133212     -0.084507
  C      -1.516697     -0.291640      1.017936
  C      -1.750345     -0.738981      2.305008
  C      -2.217390     -2.052266      2.511035
  N      -2.498237     -2.598515      3.748410
  C      -1.924746     -2.090740      4.845457
  C      -0.578492     -1.582473      5.008715
  O      -0.187206     -0.905215      5.925408
  Cl      0.641014     -2.264926      3.813556
  C      -5.904511     -5.858139      4.805375
  C      -6.706954     -6.718319      5.590830
  C      -7.983146     -6.322724      5.950352
  C      -8.500415     -5.080260      5.530970
  C      -7.723761     -4.212815      4.782500
  C      -6.403811     -4.570573      4.443885
  N      -5.534716     -3.798620      3.677719
  C      -5.858133     -2.503712      3.496877
  C      -5.512856     -1.755594      2.317947
  O      -5.213111     -2.164470      1.220001
  Cl     -5.674466      0.028406      2.617951
  C      -1.366280     -5.181092      5.664652
  C      -0.121725     -5.566229      6.227747
  C       0.153393     -5.264677      7.545154
  C      -0.782142     -4.558424      8.339307
  C      -2.010070     -4.202082      7.826120
  C      -2.347070     -4.552024      6.497360
  N      -3.526743     -4.221835      5.873623
  C      -4.617952     -3.821256      6.541728
  C      -5.054279     -4.356452      7.813915
  O      -4.632071     -5.293394      8.447294
  Cl     -6.547289     -3.467752      8.371068
  H      -2.560437     -2.998129     -0.778944
  H      -1.594494     -0.764674     -1.095452
  H      -1.158725      0.724818      0.854412
  H      -1.604517     -0.077536      3.158675
  H      -2.467527     -2.151422      5.786347
  H      -6.319666     -7.678186      5.929282
  H      -8.597025     -6.984187      6.562490
  H      -9.519886     -4.800156      5.796051
  H      -8.143451     -3.267813      4.440233
  H      -6.512806     -2.001385      4.212870
  H       0.631861     -6.055250      5.613301
  H       1.122239     -5.533901      7.967284
  H      -0.519468     -4.272156      9.357742
  H      -2.707894     -3.623260      8.427243
  H      -5.302682     -3.145382      6.042302
  N      -7.079088     -5.529473      1.569471
  N      -7.768527     -6.029744      0.766931
  H      -7.362578     -6.421795     -0.139591
74
Coordinates from ORCA-job orca E -7352.998848319635
  N      -3.140005     -4.058043      1.727883
  C      -3.585404     -4.920332      0.637406
  C      -3.724915     -6.352382      1.151688
  N      -2.990023     -6.476434      2.434346
  C      -3.363981     -7.745172      3.149122
  C      -4.018082     -7.420559      4.491189
  N      -4.657376     -6.128154      4.328278
  Mo     -3.483798     -4.604455      3.658635
  N      -1.712313     -5.345782      4.364290
  C      -0.819932     -6.137688      3.516726
  C      -1.518754     -6.399294      2.194906
  H      -0.578036     -7.080982      4.034241
  H       0.129824     -5.607901      3.338071
  H      -1.169056     -7.334118      1.729715
  H      -1.331941     -5.579170      1.495188
  H      -4.742088     -8.203937      4.752728
  H      -3.269098     -7.371837      5.297130
  H      -4.065064     -8.295454      2.509920
  H      -2.471351     -8.369040      3.281320
  H      -2.864733     -4.876937     -0.191254
  H      -4.551965     -4.550116      0.258266
  H      -3.306649     -7.073200      0.429307
  H      -4.776743     -6.616914      1.312553
  C      -2.548107     -2.871367      1.400578
  C      -2.292189     -2.398884      0.092516
  C      -1.761037     -1.132917     -0.083896
  C      -1.507158     -0.290929      1.018558
  C      -1.743173     -0.737099      2.305655
  C      -2.211487     -2.049865      2.512098
  N      -2.494896     -2.595708      3.749386
  C      -1.922740     -2.088711      4.847526
  C      -0.576399     -1.581420      5.013721
  O      -0.187825     -0.899644      5.928237
  Cl      0.646200     -2.266312      3.822992
  C      -5.899820     -5.859064      4.804894
  C      -6.701581     -6.718187      5.592082
  C      -7.978767     -6.323158      5.949095
  C      -8.497271     -5.082826      5.525313
  C      -7.721161     -4.216436      4.774699
  C      -6.400590     -4.573519      4.438763
  N      -5.530195     -3.802655      3.671699
  C      -5.854894     -2.507471      3.491310
  C      -5.505007     -1.754593      2.316944
  O      -5.201991     -2.158261      1.218059
  Cl     -5.673852      0.027936      2.622848
  C      -1.365388     -5.182772      5.665263
  C      -0.121825     -5.569628      6.229747
  C       0.151420     -5.270929      7.548106
  C      -0.784729     -4.565537      8.342406
  C      -2.011651     -4.207451      7.828181
  C      -2.347287     -4.554595      6.498219
  N      -3.525454     -4.221328      5.873447
  C      -4.619299     -3.820983      6.536271
  C      -5.061843     -4.353256      7.807798
  O      -4.640732     -5.286619      8.447095
  Cl     -6.556578     -3.462426      8.356278
  H      -2.550626     -2.997960     -0.777934
  H      -1.581253     -0.765106     -1.094673
  H      -1.147943      0.725078      0.854907
  H      -1.598103     -0.074948      3.158865
  H      -2.467191     -2.149669      5.787448
  H      -6.312598     -7.676174      5.933953
  H      -8.592509     -6.983463      6.562644
  H      -9.517497     -4.803452      5.788273
  H      -8.142260     -3.273457      4.428619
  H      -6.512374     -2.007560      4.206391
  H       0.632645     -6.057463      5.615412
  H       1.119472     -5.541635      7.971155
  H      -0.523183     -4.281357      9.361716
  H      -2.709634     -3.629061      8.429342
  H      -5.303910     -3.149038      6.031128
  N      -7.130045     -5.533203      1.557402
  N      -7.828461     -6.056476      0.777474
  H      -7.436589     -6.464105     -0.128245
74
Coordinates from ORCA-job orca E -7352.999158270473
  N      -3.139896     -4.054128      1.728271
  C      -3.587619     -4.917386      0.639663
  C      -3.732377     -6.346463      1.160395
  N      -2.986858     -6.470437      2.437045
  C      -3.354028     -7.741126      3.152814
  C      -4.009951     -7.418794      4.494640
  N      -4.651422     -6.127796      4.331392
  Mo     -3.483234     -4.601390      3.657484
  N      -1.709855     -5.343118      4.365246
  C      -0.814985     -6.126554      3.512768
  C      -1.516642     -6.391107      2.192102
  H      -0.563424     -7.069137      4.026833
  H       0.129795     -5.588580      3.331841
  H      -1.167078     -7.326444      1.727967
  H      -1.332755     -5.572208      1.490301
  H      -4.732891     -8.203484      4.755231
  H      -3.261467     -7.369416      5.301015
  H      -4.051262     -8.295958      2.513272
  H      -2.457551     -8.359198      3.285717
  H      -2.867433     -4.879301     -0.189684
  H      -4.553504     -4.545751      0.260160
  H      -3.329460     -7.073924      0.436063
  H      -4.784557     -6.598752      1.337055
  C      -2.543828     -2.869908      1.400085
  C      -2.285178     -2.400039      0.091722
  C      -1.749278     -1.136176     -0.085324
  C      -1.493327     -0.294419      1.016860
  C      -1.732053     -0.738387      2.304339
  C      -2.205652     -2.049007      2.511558
  N      -2.492614     -2.593582      3.748602
  C      -1.921760     -2.085789      4.847377
  C      -0.576000     -1.577885      5.013898
  O      -0.186709     -0.898987      5.930259
  Cl      0.647185     -2.266824      3.825698
  C      -5.896907     -5.862590      4.802136
  C      -6.699214     -6.723088      5.587123
  C      -7.979745     -6.331825      5.936630
  C      -8.500352     -5.094454      5.507332
  C      -7.723356     -4.226517      4.758979
  C      -6.400004     -4.579752      4.431186
  N      -5.525997     -3.806264      3.669230
  C      -5.852922     -2.510266      3.493580
  C      -5.501787     -1.749375      2.324983
  O      -5.195346     -2.144927      1.224166
  Cl     -5.667352      0.031155      2.644801
  C      -1.365096     -5.184179      5.666404
  C      -0.121967     -5.572582      6.231360
  C       0.150585     -5.276115      7.550206
  C      -0.785404     -4.570952      8.345086
  C      -2.011709     -4.211440      7.830632
  C      -2.347305     -4.556915      6.500141
  N      -3.524109     -4.219393      5.875292
  C      -4.616795     -3.815308      6.536282
  C      -5.061972     -4.341907      7.809748
  O      -4.646558     -5.276470      8.450798
  Cl     -6.555890     -3.446399      8.351913
  H      -2.544723     -2.999607     -0.778096
  H      -1.566690     -0.769795     -1.096109
  H      -1.129822      0.719984      0.852665
  H      -1.584762     -0.075862      3.156893
  H      -2.467115     -2.146681      5.786899
  H      -6.308146     -7.679002      5.932462
  H      -8.594558     -6.992900      6.548277
  H      -9.523045     -4.818314      5.764036
  H      -8.146305     -3.286102      4.408235
  H      -6.512998     -2.015808      4.209974
  H       0.632771     -6.059343      5.616470
  H       1.118248     -5.547942      7.973461
  H      -0.523876     -4.287988      9.364726
  H      -2.709346     -3.632894      8.431969
  H      -5.299550     -3.142796      6.029702
  N      -7.176667     -5.529902      1.546686
  N      -7.886874     -6.075784      0.793118
  H      -7.510518     -6.501813     -0.110619
74
Coordinates from ORCA-job orca E -7352.999459530347
  N      -3.139858     -4.051335      1.726301
  C      -3.583844     -4.917155      0.638064
  C      -3.738198     -6.341418      1.167865
  N      -2.982367     -6.465354      2.438533
  C      -3.344521     -7.737634      3.154882
  C      -4.001917     -7.416681      4.496398
  N      -4.645559     -6.126979      4.332318
  Mo     -3.482424     -4.598262      3.654927
  N      -1.707749     -5.340630      4.366916
  C      -0.809976     -6.116307      3.510543
  C      -1.512963     -6.383992      2.190115
  H      -0.549852     -7.058072      4.021715
  H       0.130218     -5.570704      3.328289
  H      -1.162873     -7.319845      1.727528
  H      -1.330620     -5.566283      1.486693
  H      -4.723204     -8.202555      4.757850
  H      -3.253195     -7.365527      5.302428
  H      -4.039007     -8.295573      2.514971
  H      -2.445294     -8.351488      3.288230
  H      -2.857632     -4.886945     -0.186372
  H      -4.545981     -4.543908      0.250819
  H      -3.353449     -7.078386      0.443290
  H      -4.791047     -6.577727      1.360625
  C      -2.541221     -2.868758      1.397188
  C      -2.282521     -2.400486      0.088397
  C      -1.744281     -1.137672     -0.089350
  C      -1.486317     -0.296250      1.012606
  C      -1.725185     -0.739021      2.300608
  C      -2.200810     -2.048659      2.508581
  N      -2.488633     -2.593962      3.745159
  C      -1.920235     -2.085256      4.845571
  C      -0.573918     -1.581263      5.016294
  O      -0.185570     -0.900027      5.931348
  Cl      0.651727     -2.273108      3.830977
  C      -5.892549     -5.863797      4.800854
  C      -6.695017     -6.724165      5.585605
  C      -7.976790     -6.333627      5.932060
  C      -8.497898     -5.097668      5.499681
  C      -7.720381     -4.229673      4.751430
  C      -6.396172     -4.582099      4.427679
  N      -5.519735     -3.808067      3.667499
  C      -5.847283     -2.511118      3.494953
  C      -5.494290     -1.746039      2.329847
  O      -5.188659     -2.137623      1.227412
  Cl     -5.659388      0.033304      2.656695
  C      -1.366032     -5.184106      5.668261
  C      -0.123579     -5.573032      6.235166
  C       0.146566     -5.278326      7.554709
  C      -0.790943     -4.574431      8.349268
  C      -2.016455     -4.214796      7.833336
  C      -2.349910     -4.558213      6.501714
  N      -3.525628     -4.218626      5.875730
  C      -4.620092     -3.818837      6.534775
  C      -5.066373     -4.346853      7.807916
  O      -4.647535     -5.277955      8.451439
  Cl     -6.565840     -3.457921      8.344784
  H      -2.544047     -3.000089     -0.780840
  H      -1.561434     -0.771760     -1.100254
  H      -1.120749      0.717346      0.847891
  H      -1.576106     -0.076006      3.152432
  H      -2.469141     -2.143669      5.783182
  H      -6.303307     -7.679210      5.932663
  H      -8.592318     -6.994379      6.543350
  H      -9.521693     -4.822639      5.753195
  H      -8.143965     -3.290828      4.397213
  H      -6.508207     -2.019819      4.212734
  H       0.632232     -6.058574      5.620612
  H       1.113570     -5.550424      7.979340
  H      -0.530751     -4.292437      9.369506
  H      -2.715060     -3.637005      8.434313
  H      -5.306146     -3.150652      6.026770
  N      -7.213409     -5.517121      1.531816
  N      -7.938845     -6.083978      0.808300
  H      -7.579209     -6.531435     -0.091920
74
Coordinates from ORCA-job orca E -7352.999751148463
  N      -3.140430     -4.049874      1.724093
  C      -3.575589     -4.919584      0.635162
  C      -3.743626     -6.337055      1.175950
  N      -2.977310     -6.461385      2.440264
  C      -3.335559     -7.734665      3.157133
  C      -3.993569     -7.414311      4.498362
  N      -4.639754     -6.126139      4.332408
  Mo     -3.481272     -4.594651      3.653480
  N      -1.706219     -5.338787      4.369881
  C      -0.805797     -6.108164      3.510539
  C      -1.508864     -6.377770      2.189626
  H      -0.539763     -7.049540      4.019287
  H       0.131010     -5.556781      3.328234
  H      -1.157500     -7.313557      1.727942
  H      -1.327175     -5.560387      1.485816
  H      -4.712604     -8.201424      4.762048
  H      -3.244279     -7.359965      5.303661
  H      -4.028782     -8.294469      2.517403
  H      -2.434608     -8.345910      3.290300
  H      -2.837403     -4.899650     -0.179023
  H      -4.530904     -4.544462      0.233391
  H      -3.379944     -7.085603      0.452364
  H      -4.797238     -6.554126      1.385305
  C      -2.540972     -2.868076      1.393764
  C      -2.284627     -2.400442      0.084448
  C      -1.744830     -1.138282     -0.094026
  C      -1.482922     -0.297931      1.007787
  C      -1.719924     -0.740236      2.296470
  C      -2.197571     -2.048892      2.504891
  N      -2.484314     -2.596024      3.740771
  C      -1.917704     -2.086053      4.842653
  C      -0.570997     -1.585981      5.016140
  O      -0.180900     -0.907673      5.932667
  Cl      0.654750     -2.277741      3.829049
  C      -5.888688     -5.866187      4.797993
  C      -6.692163     -6.728035      5.579859
  C      -7.976023     -6.339687      5.921599
  C      -8.497652     -5.104684      5.487420
  C      -7.718799     -4.234889      4.742254
  C      -6.392997     -4.585320      4.423922
  N      -5.513802     -3.808685      3.668624
  C      -5.842246     -2.510876      3.499506
  C      -5.490577     -1.743591      2.335578
  O      -5.187235     -2.133551      1.231912
  Cl     -5.652630      0.035161      2.666644
  C      -1.367237     -5.184730      5.671381
  C      -0.125404     -5.574527      6.239896
  C       0.143264     -5.280428      7.559648
  C      -0.794693     -4.575878      8.353407
  C      -2.019407     -4.215800      7.836213
  C      -2.352081     -4.559291      6.504413
  N      -3.526873     -4.217217      5.877319
  C      -4.621188     -3.818656      6.535991
  C      -5.069862     -4.349149      7.808093
  O      -4.652637     -5.281400      8.450595
  Cl     -6.570806     -3.461712      8.342419
  H      -2.549434     -2.999399     -0.784281
  H      -1.563667     -0.772208     -1.105165
  H      -1.115396      0.714903      0.842633
  H      -1.567353     -0.077416      3.147799
  H      -2.469385     -2.142190      5.778817
  H      -6.300296     -7.682781      5.927590
  H      -8.592789     -7.001595      6.530373
  H      -9.523013     -4.831669      5.736758
  H      -8.142506     -3.296891      4.385944
  H      -6.502804     -2.022475      4.219581
  H       0.630782     -6.059753      5.625564
  H       1.109723     -5.552799      7.985380
  H      -0.534909     -4.293394      9.373599
  H      -2.717784     -3.636908      8.436355
  H      -5.307863     -3.150427      6.028954
  N      -7.240193     -5.494681      1.518168
  N      -7.984260     -6.079256      0.827945
  H      -7.642773     -6.549908     -0.067517
74
Coordinates from ORCA-job orca E -7353.000023641421
  N      -3.139356     -4.049326      1.721003
  C      -3.561889     -4.923847      0.630769
  C      -3.746475     -6.333269      1.182825
  N      -2.970588     -6.459229      2.440987
  C      -3.327300     -7.732539      3.158159
  C      -3.985801     -7.411949      4.498861
  N      -4.633931     -6.124951      4.330580
  Mo     -3.478448     -4.590766      3.652287
  N      -1.704451     -5.336921      4.373174
  C      -0.801632     -6.103090      3.513031
  C      -1.502927     -6.373391      2.190568
  H      -0.533902     -7.044550      4.020712
  H       0.133855     -5.549002      3.332404
  H      -1.149271     -7.308509      1.729244
  H      -1.320571     -5.555461      1.487721
  H      -4.702857     -8.199912      4.765066
  H      -3.236174     -7.354208      5.303606
  H      -4.020351     -8.292949      2.518672
  H      -2.425940     -8.343121      3.291304
  H      -2.807872     -4.915186     -0.169252
  H      -4.508019     -4.547100      0.209642
  H      -3.405540     -7.094133      0.460978
  H      -4.801060     -6.528892      1.408750
  C      -2.542391     -2.866593      1.389604
  C      -2.290552     -2.398306      0.079840
  C      -1.751689     -1.135655     -0.099085
  C      -1.485785     -0.296676      1.002800
  C      -1.718805     -0.739765      2.292141
  C      -2.196692     -2.048159      2.500414
  N      -2.479910     -2.598471      3.735471
  C      -1.913567     -2.087268      4.838216
  C      -0.566514     -1.590805      5.012233
  O      -0.172287     -0.919476      5.932217
  Cl      0.656691     -2.278973      3.818505
  C      -5.883733     -5.867257      4.795622
  C      -6.687790     -6.730374      5.575313
  C      -7.972565     -6.343219      5.915355
  C      -8.494383     -5.108050      5.481883
  C      -7.714929     -4.236742      4.738985
  C      -6.388456     -4.586252      4.422593
  N      -5.508812     -3.807933      3.669686
  C      -5.838087     -2.509910      3.500652
  C      -5.489677     -1.745340      2.333971
  O      -5.189289     -2.138711      1.230646
  Cl     -5.652342      0.034085      2.660054
  C      -1.368807     -5.185130      5.675408
  C      -0.128486     -5.576632      6.246671
  C       0.137065     -5.284489      7.567371
  C      -0.802440     -4.580386      8.359935
  C      -2.025616     -4.218952      7.840225
  C      -2.355169     -4.560145      6.507181
  N      -3.528393     -4.215532      5.877909
  C      -4.623386     -3.820053      6.536291
  C      -5.072560     -4.354518      7.807263
  O      -4.653648     -5.286683      8.448395
  Cl     -6.577547     -3.473315      8.339739
  H      -2.558395     -2.996548     -0.788512
  H      -1.574092     -0.768542     -1.110480
  H      -1.117887      0.716018      0.837495
  H      -1.562421     -0.077804      3.143445
  H      -2.466353     -2.141799      5.773824
  H      -6.296455     -7.685571      5.922407
  H      -8.589839     -7.006398      6.522228
  H      -9.520391     -4.836106      5.729764
  H      -8.138180     -3.298527      4.382734
  H      -6.496818     -2.021612      4.222490
  H       0.628590     -6.061530      5.633192
  H       1.102288     -5.557972      7.995212
  H      -0.544707     -4.299066      9.380962
  H      -2.724861     -3.640149      8.439583
  H      -5.311661     -3.152546      6.030309
  N      -7.256795     -5.465471      1.504157
  N      -8.021935     -6.063783      0.848975
  H      -7.699881     -6.558177     -0.040955
74
Coordinates from ORCA-job orca E -7353.000264075453
  N      -3.135320     -4.049620      1.718977
  C      -3.545052     -4.928820      0.627680
  C      -3.747543     -6.329969      1.189495
  N      -2.962918     -6.459430      2.441671
  C      -3.319830     -7.731840      3.159142
  C      -3.979013     -7.410633      4.499082
  N      -4.628016     -6.124321      4.328349
  Mo     -3.473219     -4.587511      3.652585
  N      -1.701945     -5.336713      4.376503
  C      -0.797464     -6.102552      3.517139
  C      -1.496051     -6.371757      2.192628
  H      -0.531826     -7.044682      4.024687
  H       0.138658     -5.548740      3.339364
  H      -1.139709     -7.305592      1.730660
  H      -1.312471     -5.552336      1.491979
  H      -4.695138     -8.198944      4.766525
  H      -3.229919     -7.350516      5.304155
  H      -4.013136     -8.292274      2.519853
  H      -2.418891     -8.342948      3.292680
  H      -2.775062     -4.931068     -0.157426
  H      -4.481043     -4.550466      0.186162
  H      -3.430134     -7.102182      0.469045
  H      -4.803083     -6.502978      1.431813
  C      -2.543618     -2.864491      1.386976
  C      -2.296972     -2.394857      0.076904
  C      -1.762555     -1.130226     -0.102263
  C      -1.495566     -0.291746      0.999721
  C      -1.723612     -0.736440      2.289573
  C      -2.197728     -2.046116      2.497498
  N      -2.475459     -2.600549      3.731947
  C      -1.908304     -2.088986      4.835293
  C      -0.560031     -1.598311      5.009989
  O      -0.161972     -0.931138      5.931495
  Cl      0.659883     -2.281166      3.808265
  C      -5.878647     -5.868800      4.792399
  C      -6.683388     -6.733830      5.569243
  C      -7.969354     -6.348863      5.907196
  C      -8.491924     -5.113542      5.474896
  C      -7.712086     -4.240152      4.735068
  C      -6.384462     -4.587720      4.420434
  N      -5.505578     -3.807152      3.670206
  C      -5.836336     -2.509613      3.499627
  C      -5.493249     -1.749415      2.328456
  O      -5.194579     -2.147629      1.226353
  Cl     -5.659232      0.031024      2.646108
  C      -1.369329     -5.187844      5.679866
  C      -0.130966     -5.582567      6.253310
  C       0.132686     -5.291863      7.574671
  C      -0.806499     -4.585589      8.365629
  C      -2.027829     -4.221059      7.843708
  C      -2.356059     -4.561747      6.510337
  N      -3.527419     -4.213534      5.878692
  C      -4.622388     -3.816006      6.535552
  C      -5.077467     -4.353153      7.803864
  O      -4.664622     -5.289498      8.442579
  Cl     -6.579056     -3.466401      8.335749
  H      -2.565886     -2.993310     -0.791035
  H      -1.589431     -0.761563     -1.113864
  H      -1.130366      0.721924      0.834383
  H      -1.565662     -0.075148      3.141092
  H      -2.461702     -2.141979      5.770610
  H      -6.292449     -7.689392      5.915743
  H      -8.586852     -7.014079      6.511593
  H      -9.518645     -4.843148      5.721520
  H      -8.135035     -3.301437      4.379853
  H      -6.493086     -2.020375      4.222641
  H       0.626155     -6.068436      5.640672
  H       1.096556     -5.567560      8.004135
  H      -0.549832     -4.304670      9.387028
  H      -2.726036     -3.639881      8.441843
  H      -5.306991     -3.144654      6.029760
  N      -7.268543     -5.433764      1.492197
  N      -8.055884     -6.041882      0.872731
  H      -7.755314     -6.559340     -0.011567
74
Coordinates from ORCA-job orca E -7353.000461040222
  N      -3.129338     -4.048663      1.717177
  C      -3.527068     -4.932235      0.625320
  C      -3.746421     -6.326112      1.194552
  N      -2.954406     -6.460440      2.441411
  C      -3.312655     -7.731536      3.159006
  C      -3.973238     -7.409969      4.498060
  N      -4.622220     -6.123777      4.325848
  Mo     -3.466554     -4.584618      3.652621
  N      -1.698632     -5.335648      4.378496
  C      -0.792778     -6.103255      3.521347
  C      -1.488070     -6.371070      2.194607
  H      -0.531114     -7.046044      4.029742
  H       0.144990     -5.551327      3.346807
  H      -1.128697     -7.303383      1.731755
  H      -1.303310     -5.549896      1.496489
  H      -4.689483     -8.198317      4.764932
  H      -3.225410     -7.349236      5.304244
  H      -4.005746     -8.292009      2.519404
  H      -2.412348     -8.343388      3.293608
  H      -2.743175     -4.943381     -0.146315
  H      -4.453292     -4.552973      0.164548
  H      -3.451351     -7.107588      0.474678
  H      -4.802767     -6.477149      1.452393
  C      -2.544580     -2.860177      1.385298
  C      -2.301329     -2.389093      0.075250
  C      -1.771932     -1.122194     -0.103410
  C      -1.505663     -0.284106      0.999092
  C      -1.730033     -0.730699      2.289105
  C      -2.200747     -2.041626      2.495886
  N      -2.473272     -2.599860      3.729767
  C      -1.902342     -2.088400      4.832099
  C      -0.553365     -1.599722      5.001600
  O      -0.148141     -0.942742      5.927489
  Cl      0.658832     -2.276500      3.788192
  C      -5.872329     -5.868651      4.791511
  C      -6.676166     -6.734137      5.568971
  C      -7.961934     -6.350120      5.908374
  C      -8.485960     -5.114875      5.477108
  C      -7.707652     -4.241123      4.736579
  C      -6.379764     -4.587551      4.420172
  N      -5.504467     -3.807169      3.667399
  C      -5.837513     -2.511345      3.490395
  C      -5.498966     -1.758695      2.312924
  O      -5.199442     -2.164393      1.213781
  Cl     -5.674870      0.023306      2.615715
  C      -1.369785     -5.190162      5.683729
  C      -0.134504     -5.589248      6.260505
  C       0.124856     -5.303171      7.583882
  C      -0.815847     -4.597848      8.373696
  C      -2.034466     -4.228891      7.848322
  C      -2.357783     -4.563879      6.512496
  N      -3.526136     -4.211461      5.877690
  C      -4.622696     -3.813966      6.531645
  C      -5.079728     -4.350547      7.799635
  O      -4.667341     -5.286659      8.438890
  Cl     -6.583175     -3.465428      8.327965
  H      -2.568824     -2.988656     -0.792441
  H      -1.601551     -0.752006     -1.114929
  H      -1.143235      0.730643      0.834210
  H      -1.571222     -0.070606      3.141457
  H      -2.452132     -2.142526      5.769503
  H      -6.284946     -7.689561      5.915489
  H      -8.578121     -7.016216      6.513158
  H      -9.512502     -4.845149      5.725253
  H      -8.131105     -3.302331      4.382198
  H      -6.493256     -2.018630      4.212042
  H       0.623805     -6.075088      5.649337
  H       1.086495     -5.582531      8.015991
  H      -0.562795     -4.321180      9.397165
  H      -2.733944     -3.648652      8.446048
  H      -5.305518     -3.142126      6.023843
  N      -7.280073     -5.405250      1.479534
  N      -8.088908     -6.020788      0.895127
  H      -7.811690     -6.559769      0.015958
74
Coordinates from ORCA-job orca E -7353.000610527388
  N      -3.121229     -4.047541      1.717641
  C      -3.510192     -4.934032      0.625682
  C      -3.745370     -6.321933      1.199715
  N      -2.946719     -6.462656      2.441634
  C      -3.306394     -7.732538      3.159125
  C      -3.968336     -7.411188      4.497557
  N      -4.616456     -6.124698      4.324963
  Mo     -3.458519     -4.583633      3.653723
  N      -1.694430     -5.336929      4.379778
  C      -0.788183     -6.107100      3.524676
  C      -1.480908     -6.372528      2.196116
  H      -0.530892     -7.050712      4.033733
  H       0.151604     -5.557809      3.352913
  H      -1.119472     -7.303373      1.731797
  H      -1.295433     -5.549452      1.500591
  H      -4.685765     -8.199304      4.762032
  H      -3.222130     -7.351845      5.305353
  H      -3.998948     -8.293103      2.518921
  H      -2.406525     -8.344871      3.294748
  H      -2.715875     -4.952336     -0.135531
  H      -4.427670     -4.553416      0.148704
  H      -3.471436     -7.110165      0.479104
  H      -4.801834     -6.451749      1.471878
  C      -2.543195     -2.855647      1.386687
  C      -2.301210     -2.383443      0.076895
  C      -1.779131     -1.113375     -0.100912
  C      -1.518719     -0.274124      1.002147
  C      -1.741019     -0.722485      2.291987
  C      -2.204356     -2.036148      2.497689
  N      -2.471991     -2.598026      3.731271
  C      -1.897567     -2.087733      4.832821
  C      -0.546957     -1.603031      4.999401
  O      -0.138248     -0.946914      5.924572
  Cl      0.659966     -2.274929      3.778349
  C      -5.866439     -5.869935      4.790430
  C      -6.669287     -6.735842      5.568781
  C      -7.955736     -6.354028      5.907403
  C      -8.482201     -5.120199      5.474534
  C      -7.705465     -4.246166      4.733249
  C      -6.376363     -4.589981      4.417318
  N      -5.504147     -3.809489      3.662795
  C      -5.840521     -2.516045      3.478979
  C      -5.506443     -1.769201      2.296399
  O      -5.204510     -2.180087      1.199931
  Cl     -5.692155      0.013805      2.587774
  C      -1.368598     -5.195679      5.686828
  C      -0.136181     -5.600043      6.265463
  C       0.121466     -5.316948      7.589969
  C      -0.817901     -4.608983      8.378571
  C      -2.034071     -4.234582      7.851085
  C      -2.356275     -4.567614      6.514546
  N      -3.521792     -4.209976      5.877270
  C      -4.618692     -3.805243      6.526296
  C      -5.085132     -4.337171      7.792843
  O      -4.683679     -5.277237      8.433337
  Cl     -6.580364     -3.436756      8.317367
  H      -2.564137     -2.985483     -0.790532
  H      -1.609957     -0.741788     -1.112121
  H      -1.161869      0.742684      0.837787
  H      -1.585612     -0.062555      3.145116
  H      -2.444671     -2.142657      5.771755
  H      -6.276644     -7.690021      5.917096
  H      -8.570578     -7.020785      6.512834
  H      -9.509196     -4.852045      5.722505
  H      -8.130371     -3.308381      4.377996
  H      -6.497232     -2.020610      4.197933
  H       0.622116     -6.087236      5.655369
  H       1.081284     -5.600500      8.023394
  H      -0.566115     -4.334511      9.402945
  H      -2.732073     -3.651906      8.447913
  H      -5.293438     -3.128296      6.014598
  N      -7.295935     -5.381204      1.468398
  N      -8.124869     -6.001875      0.918140
  H      -7.873525     -6.560237      0.043372
74
Coordinates from ORCA-job orca E -7353.000713449745
  N      -3.113361     -4.045031      1.718626
  C      -3.495851     -4.933342      0.626549
  C      -3.744630     -6.316685      1.203783
  N      -2.940313     -6.463950      2.441417
  C      -3.301070     -7.733378      3.158266
  C      -3.963842     -7.413075      4.496654
  N      -4.610940     -6.126079      4.325298
  Mo     -3.451060     -4.583771      3.653846
  N      -1.689826     -5.337473      4.379777
  C      -0.783618     -6.110012      3.526264
  C      -1.474684     -6.373837      2.196402
  H      -0.529218     -7.054060      4.035881
  H       0.157604     -5.562674      3.356147
  H      -1.112221     -7.303845      1.731177
  H      -1.288772     -5.549574      1.502577
  H      -4.682673     -8.200950      4.758258
  H      -3.218612     -7.356440      5.305549
  H      -3.992903     -8.293892      2.517138
  H      -2.401248     -8.345714      3.294340
  H      -2.694099     -4.957321     -0.127052
  H      -4.405964     -4.551321      0.136514
  H      -3.489412     -7.109753      0.481822
  H      -4.800524     -6.427204      1.488378
  C      -2.540350     -2.850370      1.389145
  C      -2.296870     -2.377456      0.079922
  C      -1.780385     -1.104895     -0.096410
  C      -1.526917     -0.264586      1.007526
  C      -1.749890     -0.714229      2.296852
  C      -2.207868     -2.029962      2.501014
  N      -2.473195     -2.594219      3.734175
  C      -1.894754     -2.085055      4.834288
  C      -0.543636     -1.599474      4.994936
  O      -0.131044     -0.946840      5.921010
  Cl      0.657392     -2.267981      3.767387
  C      -5.860147     -5.870493      4.791651
  C      -6.660821     -6.735129      5.574009
  C      -7.947228     -6.354322      5.913332
  C      -8.476474     -5.122747      5.476899
  C      -7.702326     -4.250220      4.731538
  C      -6.372650     -4.592345      4.415014
  N      -5.503849     -3.813884      3.655298
  C      -5.844138     -2.523447      3.462490
  C      -5.511858     -1.782159      2.275693
  O      -5.206362     -2.197613      1.182088
  Cl     -5.708416      0.001689      2.556289
  C      -1.367145     -5.200128      5.688631
  C      -0.137667     -5.609302      6.269563
  C       0.116991     -5.330639      7.595782
  C      -0.822638     -4.622740      8.383791
  C      -2.036328     -4.243425      7.853852
  C      -2.355332     -4.571471      6.515315
  N      -3.517833     -4.209172      5.875632
  C      -4.616067     -3.799782      6.519190
  C      -5.087348     -4.323666      7.787112
  O      -4.690643     -5.262486      8.432512
  Cl     -6.580253     -3.415725      8.304211
  H      -2.553929     -2.982095     -0.787496
  H      -1.609626     -0.732315     -1.106990
  H      -1.174308      0.753849      0.844033
  H      -1.598562     -0.054519      3.150954
  H      -2.437138     -2.142817      5.775820
  H      -6.265794     -7.687189      5.925440
  H      -8.559994     -7.019942      6.522131
  H      -9.503542     -4.855466      5.725522
  H      -8.129497     -3.314499      4.373578
  H      -6.503813     -2.024964      4.176699
  H       0.621468     -6.096809      5.660767
  H       1.074775     -5.618406      8.030942
  H      -0.573490     -4.352501      9.409943
  H      -2.734863     -3.661226      8.450498
  H      -5.286352     -3.122427      6.001967
  N      -7.317917     -5.364292      1.455545
  N      -8.164596     -5.989375      0.937855
  H      -7.940378     -6.564918      0.066866
74
Coordinates from ORCA-job orca E -7353.000772239361
  N      -3.106305     -4.042854      1.720656
  C      -3.484899     -4.931558      0.627873
  C      -3.745394     -6.311263      1.207333
  N      -2.936590     -6.464746      2.441523
  C      -3.298187     -7.734587      3.157100
  C      -3.959844     -7.415691      4.496467
  N      -4.605972     -6.128169      4.327344
  Mo     -3.444849     -4.585486      3.654033
  N      -1.685485     -5.339045      4.379517
  C      -0.780235     -6.113597      3.526571
  C      -1.470916     -6.376028      2.196063
  H      -0.527488     -7.057967      4.036330
  H       0.161993     -5.567824      3.356859
  H      -1.109045     -7.306014      1.730421
  H      -1.284264     -5.551340      1.503091
  H      -4.679779     -8.203258      4.756256
  H      -3.214189     -7.362012      5.305197
  H      -3.990392     -8.293997      2.515349
  H      -2.398474     -8.347331      3.292021
  H      -2.677920     -4.960817     -0.120208
  H      -4.388867     -4.547243      0.128205
  H      -3.505912     -7.107773      0.483977
  H      -4.799837     -6.405281      1.501913
  C      -2.535874     -2.846467      1.392850
  C      -2.289813     -2.373093      0.084327
  C      -1.777988     -1.098434     -0.090480
  C      -1.532240     -0.256838      1.014248
  C      -1.757259     -0.707316      2.302919
  C      -2.209878     -2.025138      2.505733
  N      -2.474931     -2.590831      3.738459
  C      -1.894792     -2.082545      4.837942
  C      -0.543629     -1.595093      4.995736
  O      -0.131216     -0.939958      5.920207
  Cl      0.655953     -2.262324      3.767300
  C      -5.855092     -5.872067      4.792795
  C      -6.653998     -6.735294      5.578774
  C      -7.941019     -6.355768      5.916821
  C      -8.472845     -5.127074      5.475186
  C      -7.700560     -4.256079      4.726231
  C      -6.369980     -4.596363      4.411192
  N      -5.502702     -3.819586      3.647793
  C      -5.846875     -2.531871      3.447795
  C      -5.514921     -1.793447      2.258835
  O      -5.206579     -2.210883      1.166975
  Cl     -5.717781     -0.009186      2.534208
  C      -1.364710     -5.204517      5.689480
  C      -0.137089     -5.617134      6.271485
  C       0.116537     -5.340581      7.598446
  C      -0.822294     -4.631335      8.385945
  C      -2.034464     -4.248647      7.854815
  C      -2.352748     -4.574895      6.515589
  N      -3.513334     -4.209347      5.874437
  C      -4.612036     -3.793888      6.513025
  C      -5.089240     -4.308949      7.782223
  O      -4.699207     -5.246931      8.433010
  Cl     -6.577696     -3.389910      8.291944
  H      -2.541116     -2.979918     -0.783268
  H      -1.604690     -0.725123     -1.100349
  H      -1.183718      0.763136      0.851589
  H      -1.611232     -0.047229      3.157692
  H      -2.434540     -2.142525      5.780835
  H      -6.256231     -7.684781      5.934101
  H      -8.552360     -7.019779      6.528809
  H      -9.500432     -4.860894      5.722818
  H      -8.130112     -3.322942      4.364438
  H      -6.510659     -2.031934      4.157205
  H       0.622120     -6.105523      5.663475
  H       1.073071     -5.631321      8.034383
  H      -0.574017     -4.363016      9.412813
  H      -2.732485     -3.665673      8.451146
  H      -5.277776     -3.116075      5.990445
  N      -7.342834     -5.353123      1.443444
  N      -8.204282     -5.980882      0.954843
  H      -8.006404     -6.570294      0.086872
74
Coordinates from ORCA-job orca E -7353.000802236593
  N      -3.102983     -4.041749      1.722101
  C      -3.480561     -4.929758      0.627978
  C      -3.746793     -6.307772      1.208376
  N      -2.936738     -6.464506      2.441572
  C      -3.299250     -7.735289      3.155629
  C      -3.957866     -7.417327      4.496743
  N      -4.603591     -6.129479      4.329762
  Mo     -3.442579     -4.587409      3.654025
  N      -1.683430     -5.339985      4.379218
  C      -0.779557     -6.116020      3.526228
  C      -1.470738     -6.377867      2.195744
  H      -0.527432     -7.060488      4.036110
  H       0.163240     -5.571381      3.355901
  H      -1.110385     -7.308565      1.730472
  H      -1.282924     -5.553645      1.502602
  H      -4.677880     -8.204652      4.757173
  H      -3.210317     -7.365129      5.303833
  H      -3.993402     -8.292392      2.513977
  H      -2.400119     -8.349417      3.287953
  H      -2.671389     -4.962154     -0.117667
  H      -4.381529     -4.543221      0.124699
  H      -3.514104     -7.105817      0.484576
  H      -4.799647     -6.394489      1.507679
  C      -2.532330     -2.845078      1.395435
  C      -2.284026     -2.371592      0.087425
  C      -1.773459     -1.096281     -0.086424
  C      -1.531609     -0.254150      1.018752
  C      -1.758816     -0.704795      2.306955
  C      -2.209685     -2.023394      2.509007
  N      -2.476335     -2.589079      3.741439
  C      -1.896659     -2.080901      4.840908
  C      -0.546258     -1.590202      4.998047
  O      -0.135753     -0.932363      5.921419
  Cl      0.654802     -2.258158      3.772128
  C      -5.853045     -5.873131      4.793864
  C      -6.651162     -6.735305      5.581853
  C      -7.938688     -6.356267      5.918524
  C      -8.471610     -5.129367      5.473320
  C      -7.699988     -4.259432      4.722299
  C      -6.368990     -4.599038      4.408757
  N      -5.501607     -3.823326      3.643517
  C      -5.847951     -2.536996      3.440094
  C      -5.514740     -1.799077      2.250941
  O      -5.205227     -2.216749      1.159620
  Cl     -5.718741     -0.014701      2.525608
  C      -1.362695     -5.205511      5.689256
  C      -0.135305     -5.618553      6.271305
  C       0.118424     -5.341895      7.598250
  C      -0.820221     -4.632252      8.385603
  C      -2.032290     -4.249326      7.854385
  C      -2.350637     -4.575577      6.515130
  N      -3.511059     -4.210146      5.873676
  C      -4.610070     -3.793074      6.510515
  C      -5.088223     -4.303639      7.781089
  O      -4.698875     -5.239369      8.435552
  Cl     -6.576905     -3.382386      8.286513
  H      -2.532469     -2.979089     -0.780524
  H      -1.598001     -0.722805     -1.095855
  H      -1.184417      0.766362      0.856627
  H      -1.615780     -0.044317      3.161937
  H      -2.435645     -2.142235      5.784120
  H      -6.251788     -7.683202      5.939645
  H      -8.549615     -7.018932      6.532382
  H      -9.499583     -4.863635      5.719819
  H      -8.130857     -3.327934      4.357900
  H      -6.514736     -2.036910      4.146567
  H       0.623747     -6.107428      5.663472
  H       1.074758     -5.633102      8.034307
  H      -0.571960     -4.364082      9.412509
  H      -2.730360     -3.666463      8.450731
  H      -5.275866     -3.117178      5.985425
  N      -7.358242     -5.350284      1.435865
  N      -8.226571     -5.978651      0.962096
  H      -8.043754     -6.574059      0.094953
74
Coordinates from ORCA-job orca E -7353.000829958716
  N      -3.100536     -4.041170      1.723620
  C      -3.478364     -4.927747      0.627369
  C      -3.749382     -6.304303      1.208549
  N      -2.939438     -6.463436      2.441831
  C      -3.303545     -7.735733      3.153563
  C      -3.956034     -7.418616      4.497750
  N      -4.601763     -6.130591      4.333303
  Mo     -3.442039     -4.589860      3.654251
  N      -1.682174     -5.340794      4.379004
  C      -0.780452     -6.118713      3.525673
  C      -1.472873     -6.380031      2.195636
  H      -0.529032     -7.063293      4.035761
  H       0.163087     -5.575723      3.354033
  H      -1.115040     -7.312017      1.731159
  H      -1.283167     -5.556869      1.501780
  H      -4.675161     -8.205735      4.761237
  H      -3.204728     -7.366909      5.301364
  H      -4.002128     -8.288311      2.512860
  H      -2.405877     -8.353010      3.280802
  H      -2.667542     -4.963423     -0.116270
  H      -4.376979     -4.538051      0.122574
  H      -3.520854     -7.103990      0.485317
  H      -4.800351     -6.386247      1.511952
  C      -2.528019     -2.845012      1.398126
  C      -2.277157     -2.371665      0.090613
  C      -1.766269     -1.096353     -0.082469
  C      -1.527013     -0.253893      1.023003
  C      -1.756882     -0.704327      2.310769
  C      -2.207535     -2.023174      2.512328
  N      -2.477183     -2.588009      3.744522
  C      -1.899847     -2.079477      4.844522
  C      -0.550793     -1.584485      5.003071
  O      -0.144253     -0.922185      5.924889
  Cl      0.654515     -2.254635      3.782875
  C      -5.852272     -5.874572      4.794720
  C      -6.650286     -6.736073      5.583471
  C      -7.938742     -6.357683      5.917571
  C      -8.472199     -5.132397      5.468955
  C      -7.700428     -4.263057      4.717038
  C      -6.368914     -4.602055      4.406043
  N      -5.500286     -3.826726      3.640451
  C      -5.848510     -2.541279      3.435276
  C      -5.512856     -1.802391      2.247178
  O      -5.202444     -2.219222      1.155869
  Cl     -5.715503     -0.018145      2.523669
  C      -1.360086     -5.204559      5.688422
  C      -0.131841     -5.616149      6.269647
  C       0.123104     -5.337496      7.595924
  C      -0.815363     -4.627417      8.383210
  C      -2.028326     -4.246222      7.852776
  C      -2.347782     -4.574428      6.514246
  N      -3.509224     -4.211356      5.873185
  C      -4.608300     -3.794460      6.510040
  C      -5.085404     -4.302899      7.781771
  O      -4.694343     -5.235920      8.439064
  Cl     -6.576360     -3.383127      8.284436
  H      -2.523712     -2.979103     -0.777901
  H      -1.588583     -0.723078     -1.091577
  H      -1.179951      0.766725      0.861336
  H      -1.616239     -0.043226      3.165645
  H      -2.439567     -2.141721      5.787211
  H      -6.249682     -7.682603      5.943508
  H      -8.549961     -7.019280      6.532280
  H      -9.500776     -4.867153      5.713421
  H      -8.132290     -3.332977      4.350265
  H      -6.518318     -2.042032      4.139425
  H       0.626628     -6.105588      5.661518
  H       1.079975     -5.627512      8.031566
  H      -0.566213     -4.357773      9.409505
  H      -2.726386     -3.663496      8.449253
  H      -5.276376     -3.121577      5.983939
  N      -7.373129     -5.350242      1.427860
  N      -8.247044     -5.978846      0.966403
  H      -8.078049     -6.578665      0.099438
74
Coordinates from ORCA-job orca E -7353.000857930552
  N      -3.099334     -4.040872      1.724896
  C      -3.477255     -4.926132      0.626724
  C      -3.751501     -6.302273      1.207039
  N      -2.943200     -6.462286      2.442118
  C      -3.309339     -7.735761      3.151753
  C      -3.954765     -7.418778      4.499278
  N      -4.600836     -6.130632      4.336919
  Mo     -3.443061     -4.591374      3.655121
  N      -1.681940     -5.340857      4.378833
  C      -0.782356     -6.120893      3.525413
  C      -1.476053     -6.381905      2.196070
  H      -0.532034     -7.065536      4.036034
  H       0.162097     -5.579896      3.352424
  H      -1.120471     -7.315097      1.732385
  H      -1.284516     -5.559874      1.501383
  H      -4.672485     -8.205736      4.766942
  H      -3.199381     -7.366524      5.298985
  H      -4.013422     -8.283136      2.512672
  H      -2.413706     -8.357114      3.273278
  H      -2.664926     -4.963584     -0.115064
  H      -4.374293     -4.533650      0.121512
  H      -3.522092     -7.102490      0.484757
  H      -4.802515     -6.384033      1.511022
  C      -2.524605     -2.845575      1.400337
  C      -2.271465     -2.372691      0.093099
  C      -1.759055     -1.097954     -0.079699
  C      -1.520481     -0.255350      1.025798
  C      -1.752541     -0.705255      2.313310
  C      -2.204539     -2.023731      2.514822
  N      -2.476897     -2.587306      3.746956
  C      -1.902230     -2.078254      4.847528
  C      -0.554502     -1.579594      5.008194
  O      -0.151616     -0.914045      5.929124
  Cl      0.655173     -2.251692      3.793278
  C      -5.852539     -5.875436      4.795801
  C      -6.650925     -6.736976      5.583990
  C      -7.940208     -6.359212      5.915911
  C      -8.473695     -5.134667      5.465714
  C      -7.701407     -4.265263      4.714098
  C      -6.369525     -4.603843      4.405062
  N      -5.499649     -3.828205      3.640265
  C      -5.848766     -2.542913      3.435219
  C      -5.510916     -1.802520      2.248585
  O      -5.199656     -2.218189      1.157076
  Cl     -5.711742     -0.018577      2.527471
  C      -1.357834     -5.202129      5.687371
  C      -0.128335     -5.611605      6.267412
  C       0.128159     -5.330451      7.592834
  C      -0.810173     -4.620133      8.380204
  C      -2.024384     -4.241226      7.850963
  C      -2.345188     -4.571770      6.513363
  N      -3.508118     -4.211750      5.873168
  C      -4.607001     -3.796308      6.511585
  C      -5.081479     -4.305554      7.783822
  O      -4.686806     -5.236302      8.442170
  Cl     -6.575693     -3.390217      8.286486
  H      -2.517352     -2.979687     -0.775904
  H      -1.579796     -0.725240     -1.088739
  H      -1.172398      0.764951      0.864349
  H      -1.612799     -0.043593      3.167880
  H      -2.443231     -2.141054      5.789422
  H      -6.249893     -7.682914      5.945122
  H      -8.551985     -7.020639      6.530250
  H      -9.502756     -4.869790      5.708535
  H      -8.133698     -3.335814      4.346259
  H      -6.520112     -2.044785      4.138638
  H       0.629406     -6.101494      5.658711
  H       1.085879     -5.618621      8.027819
  H      -0.559858     -4.348616      9.405724
  H      -2.722409     -3.658697      8.447720
  H      -5.278152     -3.125999      5.986098
  N      -7.386734     -5.355350      1.413057
  N      -8.264533     -5.984361      0.960073
  H      -8.104399     -6.588736      0.094598
74
Coordinates from ORCA-job orca E -7353.000891492756
  N      -3.098398     -4.040880      1.726587
  C      -3.477401     -4.924349      0.626838
  C      -3.754683     -6.300528      1.205253
  N      -2.948593     -6.461254      2.442889
  C      -3.318121     -7.735550      3.150406
  C      -3.953711     -7.417822      4.502228
  N      -4.600564     -6.129675      4.341598
  Mo     -3.445435     -4.592478      3.657127
  N      -1.682272     -5.340491      4.378506
  C      -0.785532     -6.123925      3.525303
  C      -1.480862     -6.384628      2.196996
  H      -0.537348     -7.068608      4.037053
  H       0.160442     -5.586133      3.350595
  H      -1.127965     -7.319188      1.734078
  H      -1.287222     -5.563950      1.501295
  H      -4.669202     -8.204577      4.776158
  H      -3.193078     -7.363713      5.296723
  H      -4.030522     -8.275422      2.514281
  H      -2.425947     -8.363361      3.264081
  H      -2.664028     -4.963172     -0.113579
  H      -4.373330     -4.528452      0.122490
  H      -3.521927     -7.100743      0.484178
  H      -4.806236     -6.384725      1.508474
  C      -2.521190     -2.846789      1.402883
  C      -2.266211     -2.374522      0.095672
  C      -1.751558     -1.100758     -0.077338
  C      -1.512273     -0.258016      1.027899
  C      -1.746036     -0.707144      2.315300
  C      -2.200235     -2.024881      2.517300
  N      -2.475257     -2.586503      3.749612
  C      -1.903756     -2.076810      4.850713
  C      -0.557380     -1.574707      5.014478
  O      -0.158787     -0.905021      5.934043
  Cl      0.657588     -2.249206      3.805690
  C      -5.854321     -5.876180      4.796412
  C      -6.654025     -6.738498      5.582190
  C      -7.944673     -6.361889      5.910486
  C      -8.477868     -5.137807      5.459111
  C      -7.704206     -4.267578      4.709592
  C      -6.371529     -4.605350      4.403821
  N      -5.499581     -3.828427      3.642063
  C      -5.848469     -2.542565      3.438780
  C      -5.506009     -1.799416      2.255186
  O      -5.191132     -2.212919      1.163833
  Cl     -5.704655     -0.016112      2.537866
  C      -1.354943     -5.197862      5.685702
  C      -0.123522     -5.604175      6.263867
  C       0.135411     -5.319219      7.587958
  C      -0.802503     -4.608400      8.375515
  C      -2.018608     -4.232756      7.848252
  C      -2.341655     -4.566953      6.512158
  N      -3.506969     -4.211429      5.873634
  C      -4.605562     -3.798977      6.515283
  C      -5.075883     -4.312455      7.787040
  O      -4.676539     -5.242356      8.443798
  Cl     -6.576247     -3.406737      8.291002
  H      -2.512402     -2.980756     -0.773752
  H      -1.571466     -0.728937     -1.086569
  H      -1.162623      0.761741      0.866439
  H      -1.606384     -0.044756      3.169299
  H      -2.446654     -2.139810      5.791472
  H      -6.253265     -7.684194      5.944274
  H      -8.557640     -7.024052      6.522847
  H      -9.507754     -4.873634      5.699192
  H      -8.136469     -3.338422      4.340968
  H      -6.521031     -2.046073      4.142140
  H       0.633084     -6.094713      5.654250
  H       1.094481     -5.604577      8.021810
  H      -0.550293     -4.333981      9.399805
  H      -2.716296     -3.650158      8.445393
  H      -5.280856     -3.131211      5.991905
  N      -7.394632     -5.364805      1.391649
  N      -8.279530     -5.993098      0.951123
  H      -8.130595     -6.606092      0.089819
74
Coordinates from ORCA-job orca E -7353.000910092705
  N      -3.097370     -4.040620      1.727568
  C      -3.478576     -4.921905      0.626965
  C      -3.758810     -6.298340      1.202846
  N      -2.954519     -6.460295      2.442694
  C      -3.328210     -7.734835      3.148265
  C      -3.952639     -7.415786      4.504628
  N      -4.601183     -6.128032      4.345113
  Mo     -3.449342     -4.592528      3.658892
  N      -1.683401     -5.338638      4.376654
  C      -0.789622     -6.126463      3.524290
  C      -1.486408     -6.387121      2.197048
  H      -0.544430     -7.071015      4.037884
  H       0.158282     -5.592641      3.347904
  H      -1.135801     -7.322808      1.734692
  H      -1.290996     -5.567634      1.500431
  H      -4.665056     -8.202612      4.785984
  H      -3.186388     -7.358486      5.293332
  H      -4.050546     -8.265942      2.516086
  H      -2.440465     -8.370504      3.252980
  H      -2.664895     -4.961913     -0.112945
  H      -4.373787     -4.522385      0.124198
  H      -3.522264     -7.098158      0.482664
  H      -4.810998     -6.386010      1.504829
  C      -2.515089     -2.849171      1.404911
  C      -2.255530     -2.378889      0.097647
  C      -1.735918     -1.107310     -0.075857
  C      -1.495742     -0.264005      1.028799
  C      -1.733857     -0.710942      2.316069
  C      -2.193106     -2.026869      2.518992
  N      -2.473873     -2.584603      3.751542
  C      -1.907049     -2.073818      4.853559
  C      -0.562043     -1.568828      5.022292
  O      -0.168417     -0.896760      5.941971
  Cl      0.659833     -2.248465      3.822856
  C      -5.857160     -5.877251      4.795982
  C      -6.657959     -6.741201      5.578578
  C      -7.949914     -6.366254      5.903946
  C      -8.483156     -5.142160      5.452932
  C      -7.708375     -4.270284      4.706344
  C      -6.374969     -4.606884      4.402900
  N      -5.501911     -3.827893      3.644512
  C      -5.850876     -2.540878      3.446448
  C      -5.509438     -1.792877      2.265743
  O      -5.201157     -2.202265      1.170902
  Cl     -5.710618     -0.011244      2.554793
  C      -1.352423     -5.191267      5.682372
  C      -0.118857     -5.593648      6.258650
  C       0.142136     -5.305097      7.581541
  C      -0.796045     -4.595005      8.369542
  C      -2.014257     -4.223240      7.844330
  C      -2.338848     -4.560369      6.509426
  N      -3.506953     -4.210360      5.873032
  C      -4.605674     -3.803314      6.519070
  C      -5.068853     -4.323354      7.790240
  O      -4.656510     -5.246751      8.448268
  Cl     -6.569684     -3.423434      8.305563
  H      -2.502135     -2.984491     -0.772067
  H      -1.553103     -0.737568     -1.085376
  H      -1.142377      0.754428      0.867103
  H      -1.594251     -0.047463      3.169215
  H      -2.453426     -2.136183      5.792350
  H      -6.257619     -7.687009      5.940841
  H      -8.563680     -7.030098      6.513686
  H      -9.513838     -4.879080      5.690791
  H      -8.140578     -3.341018      4.337836
  H      -6.522554     -2.047881      4.153069
  H       0.636961     -6.084239      5.648084
  H       1.102703     -5.587107      8.014263
  H      -0.542394     -4.318159      9.392835
  H      -2.712373     -3.641638      8.442102
  H      -5.286521     -3.138745      5.998838
  N      -7.391194     -5.376953      1.364178
  N      -8.288751     -6.001956      0.943201
  H      -8.156003     -6.629046      0.089577
74
Coordinates from ORCA-job orca E -7353.000949536315
  N      -3.097285     -4.040815      1.729506
  C      -3.482143     -4.920110      0.629340
  C      -3.764176     -6.297053      1.202721
  N      -2.960469     -6.461103      2.443700
  C      -3.339423     -7.734799      3.148185
  C      -3.953136     -7.413418      4.508549
  N      -4.603214     -6.125963      4.349049
  Mo     -3.453432     -4.592682      3.662158
  N      -1.684298     -5.336778      4.374914
  C      -0.793892     -6.130327      3.524077
  C      -1.492264     -6.391453      2.198065
  H      -0.552479     -7.074410      4.040451
  H       0.156303     -5.601294      3.345741
  H      -1.143806     -7.328224      1.736275
  H      -1.295401     -5.573209      1.500388
  H      -4.662623     -8.200102      4.797315
  H      -3.181904     -7.352420      5.291925
  H      -4.072238     -8.256665      2.520468
  H      -2.456990     -8.379271      3.244270
  H      -2.669839     -4.960786     -0.112008
  H      -4.377803     -4.517744      0.129441
  H      -3.524752     -7.096152      0.482706
  H      -4.816717     -6.388329      1.503787
  C      -2.512663     -2.850969      1.407391
  C      -2.251795     -2.381647      0.099707
  C      -1.728935     -1.111660     -0.074759
  C      -1.486213     -0.268105      1.029227
  C      -1.725524     -0.713737      2.316602
  C      -2.188366     -2.028310      2.520780
  N      -2.472070     -2.582724      3.753852
  C      -1.907723     -2.071637      4.855874
  C      -0.563802     -1.563590      5.027241
  O      -0.173610     -0.889114      5.946301
  Cl      0.662157     -2.244170      3.832126
  C      -5.861766     -5.877499      4.794993
  C      -6.664978     -6.742875      5.573274
  C      -7.958358     -6.369010      5.894499
  C      -8.490761     -5.144480      5.443672
  C      -7.713703     -4.271122      4.701193
  C      -6.379343     -4.607104      4.401348
  N      -5.504069     -3.826435      3.647839
  C      -5.850156     -2.537831      3.453450
  C      -5.498257     -1.785140      2.278860
  O      -5.172330     -2.190171      1.187427
  Cl     -5.685168     -0.003865      2.577436
  C      -1.348907     -5.183081      5.678848
  C      -0.112658     -5.580251      6.252876
  C       0.151058     -5.286614      7.574091
  C      -0.787234     -4.576974      8.362420
  C      -2.008154     -4.210402      7.839775
  C      -2.335009     -4.552083      6.506640
  N      -3.506842     -4.209491      5.873130
  C      -4.606607     -3.810249      6.523944
  C      -5.062960     -4.340671      7.792537
  O      -4.644384     -5.266635      8.443203
  Cl     -6.580436     -3.466930      8.306440
  H      -2.499911     -2.986611     -0.769992
  H      -1.545908     -0.743365     -1.084785
  H      -1.130485      0.749427      0.867090
  H      -1.584922     -0.049521      3.169004
  H      -2.455709     -2.134292      5.793753
  H      -6.266271     -7.689211      5.935958
  H      -8.573735     -7.034623      6.500682
  H      -9.522419     -4.882227      5.678192
  H      -8.144804     -3.341424      4.332343
  H      -6.522965     -2.046686      4.160286
  H       0.642411     -6.070910      5.641427
  H       1.113593     -5.564242      8.005271
  H      -0.531659     -4.296504      9.384264
  H      -2.706635     -3.629527      8.437944
  H      -5.293568     -3.149447      6.006993
  N      -7.375004     -5.392027      1.337238
  N      -8.291060     -6.009591      0.942649
  H      -8.180249     -6.655104      0.099849
74
Coordinates from ORCA-job orca E -7353.000987775828
  N      -3.097102     -4.041342      1.730442
  C      -3.484560     -4.920728      0.631875
  C      -3.766019     -6.297595      1.205829
  N      -2.960006     -6.463474      2.444420
  C      -3.339620     -7.735843      3.149977
  C      -3.954905     -7.413446      4.509273
  N      -4.605032     -6.126163      4.347978
  Mo     -3.453397     -4.592700      3.663396
  N      -1.683697     -5.336726      4.373968
  C      -0.793781     -6.131624      3.523778
  C      -1.492388     -6.393356      2.198026
  H      -0.553094     -7.075305      4.041171
  H       0.156747     -5.603340      3.345096
  H      -1.143461     -7.329872      1.736051
  H      -1.296467     -5.574913      1.500283
  H      -4.664765     -8.200075      4.797343
  H      -3.184985     -7.351817      5.293887
  H      -4.072358     -8.258066      2.522402
  H      -2.457585     -8.380747      3.247095
  H      -2.674697     -4.961650     -0.112251
  H      -4.381369     -4.519090      0.133205
  H      -3.529983     -7.096602      0.484447
  H      -4.817999     -6.387161      1.508397
  C      -2.512421     -2.851776      1.408022
  C      -2.251631     -2.382848      0.100066
  C      -1.728802     -1.112989     -0.074911
  C      -1.486263     -0.268852      1.028739
  C      -1.725577     -0.713962      2.316233
  C      -2.187966     -2.028634      2.521043
  N      -2.472165     -2.582103      3.754420
  C      -1.907806     -2.071409      4.856457
  C      -0.563308     -1.564588      5.028794
  O      -0.174369     -0.887221      5.946246
  Cl      0.663102     -2.244175      3.834094
  C      -5.864413     -5.878121      4.791661
  C      -6.669279     -6.744445      5.567247
  C      -7.963482     -6.371306      5.885776
  C      -8.495404     -5.146465      5.434894
  C      -7.716836     -4.272103      4.695413
  C      -6.381575     -4.607353      4.398202
  N      -5.504956     -3.825474      3.648127
  C      -5.848691     -2.535977      3.456170
  C      -5.490065     -1.779773      2.285838
  O      -5.165900     -2.181466      1.192728
  Cl     -5.692049     -0.000220      2.585397
  C      -1.347239     -5.181982      5.677637
  C      -0.110324     -5.578057      6.250875
  C       0.154492     -5.283347      7.571661
  C      -0.783316     -4.573573      8.360334
  C      -2.004889     -4.208023      7.838493
  C      -2.332893     -4.551096      6.505952
  N      -3.505588     -4.209618      5.873626
  C      -4.604969     -3.809926      6.525441
  C      -5.060683     -4.341195      7.793632
  O      -4.645248     -5.271575      8.440179
  Cl     -6.580472     -3.471063      8.306462
  H      -2.499890     -2.988452     -0.769150
  H      -1.545718     -0.745066     -1.085062
  H      -1.130874      0.748723      0.866151
  H      -1.585540     -0.049430      3.168476
  H      -2.456569     -2.133332      5.793950
  H      -6.271495     -7.691144      5.929995
  H      -8.579900     -7.037875      6.489844
  H      -9.527769     -4.884985      5.667131
  H      -8.147018     -3.342116      4.326191
  H      -6.523252     -2.045930      4.162156
  H       0.644748     -6.068487      5.639242
  H       1.117646     -5.560133      8.001997
  H      -0.526981     -4.292191      9.381739
  H      -2.703250     -3.626936      8.436575
  H      -5.290763     -3.147419      6.009297
  N      -7.356243     -5.393777      1.337287
  N      -8.282601     -6.004653      0.956412
  H      -8.183868     -6.658014      0.118151
74
Coordinates from ORCA-job orca E -7353.001054035438
  N      -3.097980     -4.042440      1.731232
  C      -3.491689     -4.922491      0.636818
  C      -3.770331     -6.299216      1.212962
  N      -2.957793     -6.469631      2.444415
  C      -3.336898     -7.738820      3.153103
  C      -3.959990     -7.414478      4.508208
  N      -4.610843     -6.128140      4.341773
  Mo     -3.454101     -4.592931      3.664238
  N      -1.682797     -5.335105      4.369884
  C      -0.793030     -6.132090      3.521297
  C      -1.491866     -6.396307      2.196027
  H      -0.552609     -7.074407      4.041137
  H       0.157463     -5.604096      3.341743
  H      -1.140402     -7.331749      1.733730
  H      -1.299486     -5.577103      1.498083
  H      -4.670951     -8.201550      4.792580
  H      -3.195042     -7.351311      5.297599
  H      -4.065775     -8.265476      2.524507
  H      -2.453849     -8.381525      3.255853
  H      -2.688626     -4.963775     -0.114963
  H      -4.391822     -4.523984      0.141039
  H      -3.544708     -7.097819      0.487392
  H      -4.820484     -6.383009      1.519941
  C      -2.511308     -2.854401      1.408129
  C      -2.248064     -2.387539      0.099704
  C      -1.724367     -1.118377     -0.076353
  C      -1.484244     -0.272122      1.026393
  C      -1.726200     -0.714899      2.314050
  C      -2.188209     -2.029573      2.520375
  N      -2.476501     -2.579622      3.754358
  C      -1.913848     -2.068978      4.857020
  C      -0.568334     -1.564434      5.033125
  O      -0.183315     -0.884978      5.950731
  Cl      0.662316     -2.250952      3.848874
  C      -5.871292     -5.880720      4.782021
  C      -6.678932     -6.749233      5.552530
  C      -7.974394     -6.377526      5.866935
  C      -8.505688     -5.151742      5.416982
  C      -7.724607     -4.275113      4.683471
  C      -6.387801     -4.608868      4.390256
  N      -5.509413     -3.824373      3.646411
  C      -5.848966     -2.533342      3.460967
  C      -5.479471     -1.767832      2.299801
  O      -5.144868     -2.159511      1.206490
  Cl     -5.674065      0.009966      2.616798
  C      -1.344471     -5.177558      5.673149
  C      -0.105886     -5.569693      6.245152
  C       0.160088     -5.273463      7.565495
  C      -0.778369     -4.566012      8.355231
  C      -2.001533     -4.204160      7.834572
  C      -2.330308     -4.548826      6.502476
  N      -3.505188     -4.211517      5.872606
  C      -4.605246     -3.814136      6.525933
  C      -5.057108     -4.346774      7.794263
  O      -4.633133     -5.272073      8.443075
  Cl     -6.564646     -3.466148      8.323831
  H      -2.495423     -2.995495     -0.768147
  H      -1.538703     -0.752007     -1.086592
  H      -1.129018      0.745299      0.862551
  H      -1.588893     -0.049248      3.165861
  H      -2.465921     -2.128474      5.792748
  H      -6.282672     -7.696789      5.914663
  H      -8.592409     -7.046099      6.467148
  H      -9.539326     -4.892058      5.645470
  H      -8.152950     -3.344353      4.313958
  H      -6.527385     -2.046836      4.165767
  H       0.650543     -6.058042      5.633520
  H       1.124751     -5.547483      7.994199
  H      -0.521658     -4.283563      9.376246
  H      -2.701479     -3.624817      8.432521
  H      -5.290319     -3.150312      6.010764
  N      -7.309766     -5.399525      1.338971
  N      -8.262460     -5.990286      0.992959
  H      -8.196776     -6.661496      0.165371
74
Coordinates from ORCA-job orca E -7353.001090831163
  N      -3.098615     -4.042833      1.731591
  C      -3.499865     -4.921829      0.640242
  C      -3.777172     -6.298726      1.217055
  N      -2.959539     -6.474339      2.442595
  C      -3.338561     -7.740977      3.153318
  C      -3.965513     -7.414140      4.505964
  N      -4.618373     -6.129183      4.335202
  Mo     -3.457959     -4.592921      3.664135
  N      -1.683153     -5.330255      4.363026
  C      -0.794782     -6.130896      3.516206
  C      -1.495052     -6.398737      2.192258
  H      -0.554504     -7.071283      4.039551
  H       0.155873     -5.604141      3.333973
  H      -1.141747     -7.333805      1.730528
  H      -1.305764     -5.579795      1.493054
  H      -4.675667     -8.201983      4.790273
  H      -3.202803     -7.347669      5.297260
  H      -4.065857     -8.270245      2.524877
  H      -2.455170     -8.382729      3.259220
  H      -2.703488     -4.964411     -0.118758
  H      -4.402754     -4.524247      0.148312
  H      -3.560469     -7.096225      0.487222
  H      -4.825905     -6.377558      1.527165
  C      -2.500107     -2.861151      1.408917
  C      -2.224099     -2.400764      0.100570
  C      -1.689266     -1.136634     -0.076345
  C      -1.450923     -0.287751      1.025012
  C      -1.705681     -0.723685      2.312340
  C      -2.178516     -2.034375      2.520453
  N      -2.482245     -2.575099      3.754628
  C      -1.926336     -2.062945      4.858999
  C      -0.582225     -1.554677      5.041424
  O      -0.205283     -0.872488      5.960261
  Cl      0.655280     -2.238354      3.865397
  C      -5.878283     -5.881731      4.776277
  C      -6.686142     -6.751457      5.545411
  C      -7.980551     -6.378925      5.862811
  C      -8.511232     -5.150976      5.417498
  C      -7.729942     -4.273313      4.685848
  C      -6.394119     -4.608202      4.388953
  N      -5.516868     -3.822244      3.646145
  C      -5.854615     -2.529579      3.472661
  C      -5.490333     -1.751493      2.317901
  O      -5.168469     -2.129644      1.216432
  Cl     -5.663792      0.023516      2.663648
  C      -1.340496     -5.164581      5.664636
  C      -0.097980     -5.546961      6.234286
  C       0.169807     -5.245500      7.553200
  C      -0.771348     -4.543052      8.344172
  C      -1.998421     -4.191005      7.826014
  C      -2.327807     -4.539791      6.494999
  N      -3.507939     -4.215016      5.868792
  C      -4.612850     -3.832511      6.524766
  C      -5.057203     -4.377145      7.789561
  O      -4.622874     -5.303356      8.430789
  Cl     -6.589052     -3.535195      8.312301
  H      -2.470204     -3.010847     -0.766148
  H      -1.493018     -0.775336     -1.086410
  H      -1.087498      0.726525      0.859725
  H      -1.570787     -0.055957      3.162934
  H      -2.484515     -2.119874      5.791288
  H      -6.290882     -7.700470      5.904728
  H      -8.598263     -7.048578      6.462154
  H      -9.544461     -4.891292      5.647785
  H      -8.156849     -3.340943      4.318540
  H      -6.532480     -2.050027      4.182754
  H       0.660467     -6.031982      5.622488
  H       1.137562     -5.512133      7.979564
  H      -0.514076     -4.257060      9.364058
  H      -2.701951     -3.616096      8.424129
  H      -5.306314     -3.177012      6.009972
  N      -7.269232     -5.414169      1.323089
  N      -8.255523     -5.975467      1.020337
  H      -8.236073     -6.667837      0.207416
74
Coordinates from ORCA-job orca E -7353.001174971397
  N      -3.099839     -4.044457      1.734318
  C      -3.504512     -4.921538      0.641948
  C      -3.781752     -6.299433      1.216885
  N      -2.965877     -6.474995      2.444483
  C      -3.346524     -7.742034      3.154497
  C      -3.968317     -7.413254      4.509257
  N      -4.622244     -6.128666      4.337780
  Mo     -3.461852     -4.595238      3.667004
  N      -1.683435     -5.328858      4.361675
  C      -0.797972     -6.132411      3.514786
  C      -1.501116     -6.401914      2.193015
  H      -0.557859     -7.071952      4.039911
  H       0.153267     -5.607909      3.329029
  H      -1.149978     -7.338573      1.732861
  H      -1.310992     -5.585097      1.491580
  H      -4.676323     -8.201068      4.798636
  H      -3.202522     -7.343769      5.297229
  H      -4.077918     -8.267791      2.527946
  H      -2.464951     -8.386787      3.257037
  H      -2.709731     -4.964540     -0.118423
  H      -4.408438     -4.521389      0.154295
  H      -3.560890     -7.095823      0.487204
  H      -4.830957     -6.382422      1.525446
  C      -2.497919     -2.864687      1.411884
  C      -2.219937     -2.405732      0.103342
  C      -1.681356     -1.143397     -0.074452
  C      -1.440958     -0.294119      1.026188
  C      -1.697755     -0.728215      2.313574
  C      -2.174398     -2.037489      2.522992
  N      -2.482140     -2.574474      3.757593
  C      -1.931021     -2.060943      4.862550
  C      -0.589425     -1.546070      5.049031
  O      -0.219014     -0.862354      5.969141
  Cl      0.656456     -2.235926      3.885919
  C      -5.884777     -5.882146      4.772721
  C      -6.696260     -6.752942      5.536700
  C      -7.992463     -6.381039      5.847804
  C      -8.521055     -5.152768      5.401384
  C      -7.736085     -4.273873      4.674832
  C      -6.399180     -4.608625      4.383905
  N      -5.516880     -3.820450      3.648347
  C      -5.851015     -2.526440      3.478599
  C      -5.468660     -1.741978      2.333779
  O      -5.137283     -2.114454      1.233267
  Cl     -5.643626      0.031015      2.687973
  C      -1.335427     -5.156000      5.660854
  C      -0.089153     -5.530850      6.227104
  C       0.181557     -5.224262      7.544238
  C      -0.760924     -4.524896      8.336649
  C      -1.991564     -4.180364      7.821872
  C      -2.322742     -4.532842      6.492377
  N      -3.507215     -4.217429      5.869652
  C      -4.611622     -3.843060      6.532248
  C      -5.043513     -4.393456      7.798268
  O      -4.592516     -5.311421      8.440007
  Cl     -6.581306     -3.567040      8.330794
  H      -2.467118     -3.015225     -0.763444
  H      -1.483901     -0.783646     -1.084850
  H      -1.074909      0.719097      0.860214
  H      -1.562464     -0.059302      3.163130
  H      -2.492057     -2.118330      5.793109
  H      -6.302649     -7.702384      5.896626
  H      -8.613276     -7.051601      6.442913
  H      -9.555508     -4.893541      5.626651
  H      -8.161436     -3.341080      4.306743
  H      -6.534469     -2.049027      4.184800
  H       0.668902     -6.014673      5.613837
  H       1.151951     -5.484835      7.968323
  H      -0.501824     -4.235555      9.355131
  H      -2.696913     -3.608744      8.421300
  H      -5.314161     -3.193642      6.022140
  N      -7.269384     -5.435103      1.300375
  N      -8.269450     -5.982884      1.015123
  H      -8.272270     -6.684447      0.209765
74
Coordinates from ORCA-job orca E -7353.001267006817
  N      -3.104806     -4.049706      1.737783
  C      -3.514976     -4.925664      0.643572
  C      -3.786222     -6.306311      1.217773
  N      -2.973558     -6.476720      2.448035
  C      -3.350886     -7.744868      3.158691
  C      -3.978563     -7.414156      4.510620
  N      -4.632407     -6.130156      4.335441
  Mo     -3.467992     -4.600017      3.670166
  N      -1.684544     -5.327782      4.360058
  C      -0.800758     -6.129967      3.511102
  C      -1.508555     -6.403977      2.193307
  H      -0.555489     -7.067736      4.037195
  H       0.148462     -5.603780      3.319578
  H      -1.158897     -7.342778      1.736331
  H      -1.319568     -5.590763      1.487457
  H      -4.686246     -8.202086      4.800262
  H      -3.214540     -7.342146      5.300109
  H      -4.075692     -8.276712      2.529708
  H      -2.465968     -8.383735      3.267976
  H      -2.724338     -4.967424     -0.120591
  H      -4.422775     -4.524470      0.164726
  H      -3.556020     -7.100362      0.488600
  H      -4.836494     -6.399598      1.522295
  C      -2.494907     -2.874015      1.415067
  C      -2.212025     -2.418590      0.106371
  C      -1.666153     -1.159686     -0.072901
  C      -1.423722     -0.309149      1.026311
  C      -1.685795     -0.739006      2.313822
  C      -2.168714     -2.045865      2.525694
  N      -2.484172     -2.576552      3.761106
  C      -1.943076     -2.060148      4.868293
  C      -0.605820     -1.535213      5.064288
  O      -0.250659     -0.837496      5.979700
  Cl      0.653654     -2.215057      3.911178
  C      -5.897658     -5.883166      4.762888
  C      -6.715263     -6.756225      5.517758
  C      -8.013270     -6.384111      5.821296
  C      -8.536933     -5.153448      5.376677
  C      -7.745533     -4.272015      4.659595
  C      -6.407915     -4.607921      4.375783
  N      -5.516751     -3.815011      3.653533
  C      -5.845066     -2.518576      3.494895
  C      -5.440551     -1.720740      2.366432
  O      -5.098677     -2.080644      1.265180
  Cl     -5.594173      0.048443      2.747917
  C      -1.328280     -5.145144      5.655401
  C      -0.075329     -5.506982      6.215005
  C       0.201246     -5.191388      7.528768
  C      -0.742412     -4.496058      8.323735
  C      -1.979185     -4.164452      7.815209
  C      -2.315221     -4.525531      6.489356
  N      -3.506785     -4.225076      5.872281
  C      -4.609001     -3.860166      6.545106
  C      -5.025192     -4.417728      7.812776
  O      -4.555367     -5.326952      8.453643
  Cl     -6.565384     -3.604720      8.361541
  H      -2.460727     -3.027527     -0.760306
  H      -1.465049     -0.802875     -1.083642
  H      -1.052752      0.702010      0.858722
  H      -1.550832     -0.067584      3.161340
  H      -2.511307     -2.117247      5.794506
  H      -6.324673     -7.707740      5.875393
  H      -8.639620     -7.056160      6.408878
  H      -9.572605     -4.893862      5.595866
  H      -8.167524     -3.336910      4.293485
  H      -6.536983     -2.046624      4.196480
  H       0.682121     -5.988287      5.598945
  H       1.176487     -5.441339      7.948062
  H      -0.479158     -4.199743      9.339138
  H      -2.686354     -3.596671      8.416374
  H      -5.323291     -3.217705      6.042880
  N      -7.278064     -5.468083      1.282807
  N      -8.289360     -5.993244      1.006830
  H      -8.316235     -6.694675      0.201767
74
Coordinates from ORCA-job orca E -7353.001342635525
  N      -3.108777     -4.056480      1.741453
  C      -3.527320     -4.931433      0.647766
  C      -3.793016     -6.314236      1.222891
  N      -2.979124     -6.481055      2.451857
  C      -3.350842     -7.749171      3.165098
  C      -3.993088     -7.415348      4.509791
  N      -4.646183     -6.132219      4.327210
  Mo     -3.473421     -4.605404      3.672856
  N      -1.683460     -5.323926      4.354724
  C      -0.801059     -6.125156      3.503985
  C      -1.514663     -6.407422      2.191379
  H      -0.548399     -7.059459      4.032846
  H       0.145044     -5.596219      3.304505
  H      -1.165690     -7.348736      1.738957
  H      -1.328879     -5.599060      1.479246
  H      -4.702143     -8.203363      4.795809
  H      -3.235278     -7.340695      5.305104
  H      -4.061905     -8.293618      2.531224
  H      -2.459908     -8.376777      3.288790
  H      -2.742966     -4.973229     -0.122298
  H      -4.439593     -4.529697      0.178489
  H      -3.560474     -7.106122      0.492197
  H      -4.843619     -6.412287      1.526539
  C      -2.487153     -2.887249      1.418029
  C      -2.195161     -2.438611      0.108916
  C      -1.641256     -1.183860     -0.073158
  C      -1.401211     -0.328917      1.023268
  C      -1.672236     -0.751437      2.310962
  C      -2.160018     -2.056122      2.527329
  N      -2.487842     -2.576694      3.763916
  C      -1.962811     -2.055655      4.874965
  C      -0.629731     -1.523707      5.090465
  O      -0.296158     -0.824317      6.012511
  Cl      0.659230     -2.242780      3.998320
  C      -5.913708     -5.883516      4.747301
  C      -6.738363     -6.759396      5.491438
  C      -8.037598     -6.386279      5.788449
  C      -8.555155     -5.151740      5.348315
  C      -7.756398     -4.267318      4.642634
  C      -6.418529     -4.605261      4.364778
  N      -5.518195     -3.807006      3.657473
  C      -5.839815     -2.508097      3.514427
  C      -5.413109     -1.692036      2.406422
  O      -5.066924     -2.033624      1.301142
  Cl     -5.540753      0.070491      2.826477
  C      -1.316523     -5.126855      5.645066
  C      -0.054628     -5.469444      6.195894
  C       0.229383     -5.140453      7.504857
  C      -0.716076     -4.450545      8.302615
  C      -1.961208     -4.137911      7.802401
  C      -2.303750     -4.512768      6.482092
  N      -3.505357     -4.235401      5.872794
  C      -4.607231     -3.886159      6.556940
  C      -5.006014     -4.456401      7.823679
  O      -4.518232     -5.361740      8.457082
  Cl     -6.560862     -3.676415      8.381751
  H      -2.443402     -3.049273     -0.756626
  H      -1.433236     -0.832267     -1.084347
  H      -1.025833      0.680083      0.852544
  H      -1.541447     -0.075188      3.155134
  H      -2.545169     -2.109200      5.792592
  H      -6.351623     -7.714035      5.844777
  H      -8.670066     -7.060237      6.367240
  H      -9.591783     -4.891292      5.561888
  H      -8.174044     -3.328783      4.280273
  H      -6.541824     -2.043849      4.211084
  H       0.702980     -5.946778      5.576867
  H       1.211218     -5.375031      7.917544
  H      -0.447678     -4.143695      9.313535
  H      -2.671055     -3.575032      8.405105
  H      -5.336673     -3.254957      6.062495
  N      -7.275892     -5.510628      1.263849
  N      -8.317578     -5.989548      1.017777
  H      -8.399580     -6.695523      0.219727
74
Coordinates from ORCA-job orca E -7353.001516220302
  N      -3.111146     -4.061731      1.745381
  C      -3.536461     -4.935480      0.654457
  C      -3.799410     -6.319305      1.230341
  N      -2.980435     -6.486895      2.454880
  C      -3.348048     -7.753944      3.170752
  C      -4.006892     -7.417791      4.507111
  N      -4.658699     -6.135051      4.317275
  Mo     -3.476940     -4.610209      3.675533
  N      -1.681915     -5.320383      4.349703
  C      -0.799792     -6.121945      3.498616
  C      -1.517035     -6.412048      2.189488
  H      -0.541732     -7.052782      4.030936
  H       0.143873     -5.590862      3.293395
  H      -1.167867     -7.355026      1.740651
  H      -1.334494     -5.607389      1.472425
  H      -4.718531     -8.205823      4.786673
  H      -3.257253     -7.342006      5.310135
  H      -4.045283     -8.310229      2.531716
  H      -2.452180     -8.371304      3.309193
  H      -2.757437     -4.977685     -0.120794
  H      -4.451787     -4.533852      0.191028
  H      -3.571783     -7.109612      0.496317
  H      -4.849064     -6.414893      1.535704
  C      -2.479461     -2.898283      1.421957
  C      -2.177112     -2.456039      0.112824
  C      -1.613020     -1.206266     -0.070811
  C      -1.373239     -0.348524      1.023684
  C      -1.654568     -0.764186      2.311103
  C      -2.151991     -2.064998      2.530132
  N      -2.492470     -2.575975      3.766914
  C      -1.977596     -2.051895      4.879591
  C      -0.650403     -1.505257      5.102589
  O      -0.332699     -0.797275      6.023526
  Cl      0.650430     -2.199404      4.011837
  C      -5.927431     -5.884453      4.733026
  C      -6.757604     -6.762771      5.468400
  C      -8.057123     -6.388330      5.762252
  C      -8.569771     -5.149802      5.327732
  C      -7.765437     -4.262978      4.631406
  C      -6.427608     -4.602867      4.356455
  N      -5.521633     -3.801230      3.659579
  C      -5.837552     -2.500734      3.528179
  C      -5.393455     -1.671135      2.436431
  O      -5.043350     -1.998529      1.328468
  Cl     -5.507146      0.085559      2.884316
  C      -1.307882     -5.112126      5.636754
  C      -0.039910     -5.439472      6.182033
  C       0.247634     -5.101621      7.488149
  C      -0.700763     -4.418249      8.287937
  C      -1.951771     -4.120561      7.793054
  C      -2.296711     -4.503742      6.475777
  N      -3.505845     -4.246127      5.872290
  C      -4.609599     -3.914142      6.564419
  C      -4.992078     -4.496294      7.829725
  O      -4.483691     -5.393776      8.458645
  Cl     -6.558233     -3.746277      8.399026
  H      -2.424686     -3.068397     -0.751700
  H      -1.396411     -0.859853     -1.081995
  H      -0.990539      0.657365      0.850956
  H      -1.525331     -0.085026      3.153163
  H      -2.566052     -2.107764      5.793224
  H      -6.374500     -7.720509      5.817149
  H      -8.693917     -7.064224      6.334015
  H      -9.606819     -4.888393      5.538024
  H      -8.179330     -3.321241      4.272984
  H      -6.547302     -2.041718      4.220483
  H       0.719340     -5.912169      5.561450
  H       1.233964     -5.324373      7.896598
  H      -0.430435     -4.105083      9.296413
  H      -2.665392     -3.563701      8.397041
  H      -5.352592     -3.294808      6.075023
  N      -7.261186     -5.545195      1.253052
  N      -8.338589     -5.971965      1.041751
  H      -8.481670     -6.682510      0.255471
74
Coordinates from ORCA-job orca E -7353.001648875645
  N      -3.117312     -4.068859      1.743231
  C      -3.546713     -4.945464      0.656866
  C      -3.796983     -6.330996      1.237706
  N      -2.972436     -6.490804      2.457122
  C      -3.331035     -7.756587      3.178428
  C      -4.028703     -7.420747      4.495017
  N      -4.674840     -6.137091      4.294570
  Mo     -3.478759     -4.613753      3.673198
  N      -1.680196     -5.315024      4.345030
  C      -0.792016     -6.109075      3.492716
  C      -1.510280     -6.411282      2.186222
  H      -0.522447     -7.035253      4.027115
  H       0.145284     -5.568381      3.283913
  H      -1.158656     -7.355840      1.742798
  H      -1.333359     -5.611319      1.462510
  H      -4.748678     -8.208281      4.753981
  H      -3.299399     -7.348915      5.317211
  H      -3.995235     -8.338533      2.526996
  H      -2.424927     -8.350298      3.349495
  H      -2.773696     -4.984265     -0.124490
  H      -4.467875     -4.549843      0.199589
  H      -3.567811     -7.120421      0.503015
  H      -4.845025     -6.432110      1.543662
  C      -2.476668     -2.910552      1.418929
  C      -2.165562     -2.474421      0.109658
  C      -1.591224     -1.229648     -0.075551
  C      -1.349910     -0.369869      1.017147
  C      -1.639771     -0.779261      2.304537
  C      -2.146998     -2.075868      2.525873
  N      -2.497048     -2.579243      3.762691
  C      -1.992359     -2.051349      4.877469
  C      -0.672751     -1.487642      5.106855
  O      -0.369927     -0.775793      6.029821
  Cl      0.635572     -2.131263      3.997760
  C      -5.940715     -5.879982      4.716582
  C      -6.775183     -6.759470      5.446003
  C      -8.070537     -6.378476      5.749208
  C      -8.575253     -5.131360      5.329995
  C      -7.766537     -4.243674      4.640132
  C      -6.432333     -4.590717      4.356154
  N      -5.523836     -3.788812      3.663476
  C      -5.832459     -2.486463      3.543712
  C      -5.384494     -1.650064      2.458385
  O      -5.044423     -1.970967      1.345499
  Cl     -5.483654      0.103344      2.921357
  C      -1.303783     -5.100832      5.631015
  C      -0.032098     -5.415461      6.174420
  C       0.253347     -5.075513      7.480768
  C      -0.701039     -4.403160      8.282186
  C      -1.955587     -4.117414      7.788744
  C      -2.297058     -4.501584      6.471004
  N      -3.511055     -4.261033      5.869886
  C      -4.618104     -3.950509      6.568132
  C      -4.981459     -4.543036      7.833825
  O      -4.451816     -5.432643      8.456468
  Cl     -6.563297     -3.832398      8.410451
  H      -2.413714     -3.087996     -0.753856
  H      -1.367029     -0.888194     -1.086758
  H      -0.959554      0.632723      0.842525
  H      -1.510059     -0.097898      3.144813
  H      -2.585686     -2.113593      5.787583
  H      -6.398016     -7.723613      5.783141
  H      -8.710355     -7.055542      6.316180
  H      -9.609611     -4.864373      5.546365
  H      -8.175219     -3.295476      4.292963
  H      -6.542461     -2.028747      4.236659
  H       0.731567     -5.880252      5.553362
  H       1.242089     -5.289245      7.888151
  H      -0.433331     -4.089494      9.291221
  H      -2.675307     -3.569996      8.394412
  H      -5.376690     -3.346199      6.083240
  N      -7.244985     -5.570543      1.277967
  N      -8.337794     -5.952005      1.074718
  H      -8.515575     -6.644848      0.280245
74
Coordinates from ORCA-job orca E -7353.001828240352
  N      -3.120095     -4.076788      1.746209
  C      -3.556707     -4.951998      0.662684
  C      -3.802788     -6.338687      1.243996
  N      -2.974999     -6.495997      2.461572
  C      -3.330574     -7.760984      3.185690
  C      -4.045966     -7.422604      4.492338
  N      -4.689778     -6.138645      4.283286
  Mo     -3.484828     -4.619802      3.675979
  N      -1.679703     -5.311675      4.339264
  C      -0.791526     -6.105437      3.486402
  C      -1.514163     -6.417262      2.184718
  H      -0.515117     -7.027289      4.024776
  H       0.142438     -5.561773      3.270662
  H      -1.164288     -7.364703      1.746255
  H      -1.340270     -5.622713      1.454227
  H      -4.769008     -8.209637      4.743851
  H      -3.326753     -7.349356      5.323304
  H      -3.981001     -8.353176      2.529558
  H      -2.421263     -8.345195      3.371566
  H      -2.788985     -4.990995     -0.123696
  H      -4.481196     -4.555723      0.212863
  H      -3.571169     -7.126811      0.508662
  H      -4.848787     -6.444220      1.550521
  C      -2.468864     -2.924883      1.422143
  C      -2.149046     -2.495313      0.112448
  C      -1.567695     -1.254477     -0.075542
  C      -1.329083     -0.390014      1.014199
  C      -1.627124     -0.792543      2.301574
  C      -2.138129     -2.087232      2.527304
  N      -2.499306     -2.581202      3.764496
  C      -2.010473     -2.049870      4.882881
  C      -0.695854     -1.479845      5.132314
  O      -0.415979     -0.754814      6.051953
  Cl      0.636746     -2.130798      4.059033
  C      -5.958382     -5.880598      4.698046
  C      -6.800475     -6.763359      5.414592
  C      -8.096946     -6.381404      5.711734
  C      -8.594995     -5.129349      5.299733
  C      -7.778582     -4.238324      4.623235
  C      -6.444081     -4.587613      4.343994
  N      -5.527273     -3.780739      3.667666
  C      -5.828144     -2.475542      3.565117
  C      -5.365270     -1.624770      2.496894
  O      -5.019657     -1.930984      1.381639
  Cl     -5.439659      0.120491      2.991920
  C      -1.293854     -5.083416      5.620225
  C      -0.014429     -5.379036      6.155351
  C       0.276689     -5.026845      7.457355
  C      -0.679797     -4.360893      8.261383
  C      -1.941646     -4.093493      7.775889
  C      -2.287961     -4.490373      6.463380
  N      -3.510461     -4.272108      5.870236
  C      -4.615401     -3.977338      6.581252
  C      -4.957073     -4.581704      7.846399
  O      -4.408155     -5.466174      8.459979
  Cl     -6.546327     -3.900402      8.440678
  H      -2.396489     -3.110514     -0.750078
  H      -1.337516     -0.918710     -1.087331
  H      -0.935637      0.610872      0.836847
  H      -1.502607     -0.105873      3.138185
  H      -2.616843     -2.111996      5.784366
  H      -6.428794     -7.731468      5.746263
  H      -8.742609     -7.061515      6.268326
  H      -9.630009     -4.860842      5.511012
  H      -8.182458     -3.285944      4.281848
  H      -6.542233     -2.024214      4.258014
  H       0.749861     -5.838764      5.531246
  H       1.270966     -5.225632      7.858755
  H      -0.408341     -4.037654      9.266407
  H      -2.663815     -3.551324      8.383505
  H      -5.388058     -3.383398      6.106428
  N      -7.227356     -5.609800      1.273962
  N      -8.346915     -5.936378      1.097021
  H      -8.578781     -6.623984      0.312460
74
Coordinates from ORCA-job orca E -7353.002025464704
  N      -3.122211     -4.087253      1.747202
  C      -3.562312     -4.962673      0.666062
  C      -3.804254     -6.349189      1.248871
  N      -2.973271     -6.500212      2.467692
  C      -3.326264     -7.765075      3.194717
  C      -4.069350     -7.426467      4.486089
  N      -4.707131     -6.139895      4.267447
  Mo     -3.490497     -4.628717      3.678240
  N      -1.678988     -5.310411      4.335392
  C      -0.787726     -6.099876      3.481443
  C      -1.514028     -6.423332      2.184813
  H      -0.501098     -7.016601      4.023182
  H       0.140525     -5.549141      3.259384
  H      -1.167188     -7.374610      1.752649
  H      -1.343171     -5.635516      1.446074
  H      -4.799274     -8.212050      4.721147
  H      -3.368381     -7.355449      5.332722
  H      -3.957508     -8.369211      2.530662
  H      -2.413628     -8.337094      3.400447
  H      -2.797117     -5.001909     -0.122762
  H      -4.488739     -4.566461      0.220524
  H      -3.564737     -7.138122      0.517011
  H      -4.848310     -6.464701      1.559711
  C      -2.465130     -2.939056      1.424369
  C      -2.141152     -2.512933      0.114108
  C      -1.558486     -1.273298     -0.076300
  C      -1.323447     -0.404732      1.011088
  C      -1.624413     -0.803889      2.298619
  C      -2.133558     -2.098967      2.527999
  N      -2.499504     -2.588137      3.765279
  C      -2.025997     -2.054854      4.887800
  C      -0.716720     -1.480716      5.159097
  O      -0.456989     -0.753168      6.082295
  Cl      0.641829     -2.155117      4.134397
  C      -5.978444     -5.879991      4.675906
  C      -6.829674     -6.765224      5.377838
  C      -8.126475     -6.380157      5.670044
  C      -8.614805     -5.121145      5.268375
  C      -7.789032     -4.227542      4.606594
  C      -6.455252     -4.581881      4.329935
  N      -5.528336     -3.771535      3.672480
  C      -5.817228     -2.462011      3.587235
  C      -5.343228     -1.604375      2.529682
  O      -4.991142     -1.905249      1.414414
  Cl     -5.397129      0.135695      3.040659
  C      -1.284244     -5.068548      5.611001
  C       0.003653     -5.342829      6.136555
  C       0.301493     -4.975328      7.432878
  C      -0.655929     -4.313102      8.238245
  C      -1.925652     -4.066000      7.761810
  C      -2.279278     -4.482496      6.457647
  N      -3.510690     -4.287909      5.872346
  C      -4.613035     -4.008021      6.595895
  C      -4.939184     -4.627850      7.857294
  O      -4.378807     -5.512562      8.460134
  Cl     -6.525477     -3.958124      8.475373
  H      -2.387158     -3.128913     -0.748256
  H      -1.326502     -0.941492     -1.089020
  H      -0.931742      0.596499      0.831942
  H      -1.505853     -0.112189      3.131824
  H      -2.644530     -2.120256      5.780703
  H      -6.466470     -7.738961      5.702296
  H      -8.778864     -7.063288      6.214911
  H      -9.649374     -4.848161      5.476171
  H      -8.186245     -3.269131      4.274281
  H      -6.527930     -2.013099      4.285114
  H       0.768194     -5.796901      5.508557
  H       1.301792     -5.156886      7.827423
  H      -0.379477     -3.975756      9.237279
  H      -2.647455     -3.524880      8.370375
  H      -5.397057     -3.420828      6.132517
  N      -7.212610     -5.640218      1.293609
  N      -8.345689     -5.916750      1.133352
  H      -8.617753     -6.587337      0.348537
74
Coordinates from ORCA-job orca E -7353.002218063846
  N      -3.125093     -4.095539      1.747829
  C      -3.570142     -4.972496      0.670583
  C      -3.806186     -6.359580      1.256240
  N      -2.970442     -6.505826      2.472606
  C      -3.318364     -7.768865      3.204589
  C      -4.089590     -7.428909      4.479614
  N      -4.722857     -6.141204      4.250612
  Mo     -3.494080     -4.635742      3.678977
  N      -1.676130     -5.305585      4.329181
  C      -0.782586     -6.092126      3.474806
  C      -1.512784     -6.428154      2.183506
  H      -0.486230     -7.003318      4.020488
  H       0.140225     -5.535182      3.245858
  H      -1.166424     -7.382562      1.757969
  H      -1.346177     -5.646961      1.436797
  H      -4.824872     -8.213888      4.699393
  H      -3.406554     -7.358349      5.340953
  H      -3.926703     -8.389458      2.534124
  H      -2.401143     -8.324303      3.433191
  H      -2.810250     -5.012164     -0.123252
  H      -4.499964     -4.578800      0.229918
  H      -3.565178     -7.148767      0.525185
  H      -4.847281     -6.478415      1.569884
  C      -2.460602     -2.952244      1.424698
  C      -2.129317     -2.531964      0.114098
  C      -1.539959     -1.296041     -0.078643
  C      -1.305250     -0.423970      1.006287
  C      -1.613055     -0.816938      2.293799
  C      -2.128331     -2.109195      2.526543
  N      -2.503829     -2.589565      3.763747
  C      -2.045613     -2.049531      4.887651
  C      -0.747683     -1.451979      5.168419
  O      -0.509372     -0.721734      6.094970
  Cl      0.630294     -2.106640      4.160018
  C      -5.994983     -5.877709      4.656404
  C      -6.853508     -6.764015      5.347760
  C      -8.148941     -6.373925      5.639904
  C      -8.628275     -5.108235      5.248783
  C      -7.794961     -4.213642      4.597776
  C      -6.463161     -4.574181      4.320053
  N      -5.529063     -3.762950      3.674539
  C      -5.807262     -2.450563      3.603953
  C      -5.319056     -1.585098      2.559230
  O      -4.965880     -1.877342      1.441878
  Cl     -5.361051      0.149468      3.088197
  C      -1.275944     -5.054196      5.601710
  C       0.017119     -5.312199      6.122025
  C       0.315445     -4.940322      7.417233
  C      -0.647202     -4.290445      8.226104
  C      -1.921760     -4.058667      7.754205
  C      -2.274120     -4.478314      6.450965
  N      -3.511403     -4.303518      5.871006
  C      -4.613133     -4.044007      6.605224
  C      -4.915045     -4.673637      7.866855
  O      -4.330759     -5.547617      8.462889
  Cl     -6.512054     -4.041479      8.499191
  H      -2.374419     -3.149771     -0.747214
  H      -1.302194     -0.969590     -1.091780
  H      -0.908974      0.575027      0.824869
  H      -1.495815     -0.121756      3.124332
  H      -2.672084     -2.119069      5.774643
  H      -6.497650     -7.742927      5.664551
  H      -8.806845     -7.058340      6.176441
  H      -9.661722     -4.830550      5.455966
  H      -8.185611     -3.249768      4.273384
  H      -6.518627     -2.004088      4.302790
  H       0.784538     -5.757863      5.491524
  H       1.319185     -5.109882      7.808305
  H      -0.371738     -3.950808      9.224645
  H      -2.649077     -3.528409      8.366181
  H      -5.412556     -3.470386      6.150867
  N      -7.195159     -5.672642      1.308244
  N      -8.346399     -5.893600      1.172079
  H      -8.669175     -6.550561      0.395077
74
Coordinates from ORCA-job orca E -7353.002364805850
  N      -3.120280     -4.102679      1.743011
  C      -3.561080     -4.985757      0.669035
  C      -3.798269     -6.368786      1.260561
  N      -2.956294     -6.509294      2.478375
  C      -3.300871     -7.769364      3.216316
  C      -4.107034     -7.431230      4.470713
  N      -4.732214     -6.139794      4.233009
  Mo     -3.489283     -4.643157      3.677240
  N      -1.666624     -5.299853      4.326234
  C      -0.768019     -6.081845      3.472643
  C      -1.500144     -6.431221      2.185560
  H      -0.461667     -6.987315      4.021939
  H       0.148208     -5.516016      3.239328
  H      -1.153975     -7.389063      1.767562
  H      -1.336731     -5.656910      1.431177
  H      -4.851164     -8.214695      4.664965
  H      -3.451484     -7.365297      5.353661
  H      -3.883609     -8.406997      2.538541
  H      -2.379513     -8.305776      3.470343
  H      -2.800025     -5.029426     -0.123920
  H      -4.489227     -4.596772      0.220113
  H      -3.558209     -7.164188      0.536292
  H      -4.838654     -6.486601      1.587226
  C      -2.460812     -2.957745      1.419299
  C      -2.130452     -2.538594      0.107857
  C      -1.546681     -1.300444     -0.087048
  C      -1.315073     -0.425195      0.996391
  C      -1.620877     -0.817204      2.284442
  C      -2.132130     -2.110728      2.519310
  N      -2.506282     -2.589428      3.756578
  C      -2.058757     -2.040091      4.879319
  C      -0.776966     -1.405363      5.155250
  O      -0.555494     -0.669971      6.081637
  Cl      0.611503     -2.005713      4.128679
  C      -6.003590     -5.871931      4.641205
  C      -6.867996     -6.755883      5.326921
  C      -8.159144     -6.355696      5.626637
  C      -8.627165     -5.082079      5.247639
  C      -7.787467     -4.190391      4.600865
  C      -6.460258     -4.561995      4.315232
  N      -5.522899     -3.758401      3.669901
  C      -5.788965     -2.442224      3.601824
  C      -5.308066     -1.588249      2.545966
  O      -4.967150     -1.893129      1.427294
  Cl     -5.356857      0.153134      3.050495
  C      -1.269597     -5.053231      5.601504
  C       0.022229     -5.308980      6.125415
  C       0.311438     -4.952230      7.427337
  C      -0.660437     -4.322073      8.240138
  C      -1.933766     -4.091089      7.763215
  C      -2.273613     -4.490984      6.451024
  N      -3.509860     -4.320261      5.867990
  C      -4.613192     -4.077652      6.605962
  C      -4.892309     -4.703811      7.873862
  O      -4.285604     -5.561848      8.470461
  Cl     -6.502205     -4.107048      8.510143
  H      -2.371383     -3.159719     -0.752341
  H      -1.309750     -0.975954     -1.101022
  H      -0.922253      0.574899      0.813677
  H      -1.503765     -0.120786      3.114136
  H      -2.684718     -2.118639      5.765812
  H      -6.522166     -7.740796      5.636127
  H      -8.821111     -7.038960      6.159580
  H      -9.657031     -4.795341      5.460418
  H      -8.169434     -3.220217      4.284627
  H      -6.485809     -1.989244      4.311238
  H       0.795424     -5.743231      5.494094
  H       1.313515     -5.122516      7.822281
  H      -0.394736     -3.997940      9.246444
  H      -2.670399     -3.579337      8.380898
  H      -5.424080     -3.514946      6.156253
  N      -7.187898     -5.675592      1.350166
  N      -8.341628     -5.853403      1.236416
  H      -8.698967     -6.493282      0.459948
74
Coordinates from ORCA-job orca E -7353.002662842686
  N      -3.122827     -4.111529      1.746174
  C      -3.566058     -4.995567      0.674258
  C      -3.800123     -6.379917      1.267368
  N      -2.956173     -6.517049      2.483322
  C      -3.296104     -7.775247      3.225255
  C      -4.132182     -7.437649      4.460695
  N      -4.750226     -6.143620      4.215568
  Mo     -3.493592     -4.652733      3.679361
  N      -1.665994     -5.298885      4.321759
  C      -0.765056     -6.077167      3.467277
  C      -1.500986     -6.438351      2.185566
  H      -0.448272     -6.977101      4.019616
  H       0.145253     -5.504892      3.226679
  H      -1.154512     -7.398894      1.774028
  H      -1.341364     -5.670426      1.423900
  H      -4.882357     -8.219934      4.635527
  H      -3.497457     -7.375957      5.359160
  H      -3.851820     -8.430432      2.541363
  H      -2.371270     -8.292182      3.505198
  H      -2.807896     -5.039499     -0.121366
  H      -4.496018     -4.608258      0.227663
  H      -3.559036     -7.175564      0.543811
  H      -4.837562     -6.497736      1.593310
  C      -2.456593     -2.970513      1.424325
  C      -2.118766     -2.555085      0.113372
  C      -1.529990     -1.319624     -0.081726
  C      -1.301104     -0.442029      1.000581
  C      -1.613315     -0.830159      2.287995
  C      -2.127692     -2.122449      2.524663
  N      -2.509711     -2.596398      3.761438
  C      -2.071739     -2.050647      4.888473
  C      -0.793354     -1.413426      5.179401
  O      -0.587457     -0.672646      6.104938
  Cl      0.608317     -2.011234      4.172111
  C      -6.021545     -5.870643      4.622256
  C      -6.894243     -6.755307      5.296266
  C      -8.183222     -6.348689      5.597129
  C      -8.640595     -5.067629      5.230923
  C      -7.792710     -4.175542      4.595231
  C      -6.467984     -4.554366      4.307908
  N      -5.522998     -3.751218      3.673152
  C      -5.778001     -2.432436      3.617296
  C      -5.286759     -1.573561      2.570338
  O      -4.947515     -1.872235      1.449480
  Cl     -5.319469      0.163791      3.089967
  C      -1.261262     -5.034969      5.591658
  C       0.038440     -5.265479      6.106731
  C       0.333256     -4.889283      7.402081
  C      -0.640694     -4.263095      8.215216
  C      -1.921605     -4.056740      7.746806
  C      -2.267057     -4.479022      6.443174
  N      -3.512228     -4.340070      5.867997
  C      -4.617662     -4.122942      6.613065
  C      -4.883390     -4.767571      7.874143
  O      -4.258112     -5.616607      8.464874
  Cl     -6.497007     -4.196307      8.526033
  H      -2.357905     -3.177306     -0.746525
  H      -1.287752     -0.998136     -1.095423
  H      -0.906244      0.557079      0.816915
  H      -1.500485     -0.130680      3.115456
  H      -2.704300     -2.136621      5.769912
  H      -6.556974     -7.746132      5.595710
  H      -8.851626     -7.032746      6.120928
  H      -9.668819     -4.775378      5.444221
  H      -8.166847     -3.199448      4.287969
  H      -6.473971     -1.980287      4.328096
  H       0.813144     -5.694224      5.473422
  H       1.341256     -5.039431      7.790047
  H      -0.371171     -3.922512      9.215061
  H      -2.659682     -3.547152      8.363992
  H      -5.442654     -3.577116      6.168460
  N      -7.178282     -5.698747      1.362398
  N      -8.344848     -5.825000      1.268246
  H      -8.748288     -6.447011      0.499750
74
Coordinates from ORCA-job orca E -7353.002870673942
  N      -3.126327     -4.120887      1.748733
  C      -3.570433     -5.006953      0.678535
  C      -3.800730     -6.391923      1.274022
  N      -2.955733     -6.522900      2.489681
  C      -3.287760     -7.778627      3.237298
  C      -4.157768     -7.444261      4.450793
  N      -4.767076     -6.146656      4.200266
  Mo     -3.497613     -4.660840      3.682708
  N      -1.664052     -5.295783      4.317495
  C      -0.760977     -6.068388      3.460638
  C      -1.501889     -6.441730      2.185636
  H      -0.431799     -6.962713      4.014829
  H       0.142111     -5.488322      3.211622
  H      -1.154146     -7.404492      1.780299
  H      -1.347872     -5.679956      1.416700
  H      -4.914955     -8.225185      4.600076
  H      -3.548884     -7.390370      5.367671
  H      -3.811161     -8.454914      2.548260
  H      -2.358686     -8.270432      3.546658
  H      -2.814155     -5.051210     -0.118844
  H      -4.501750     -4.622075      0.232753
  H      -3.556120     -7.188578      0.552887
  H      -4.837494     -6.511600      1.599482
  C      -2.453269     -2.984339      1.427364
  C      -2.108359     -2.573888      0.116496
  C      -1.514691     -1.341251     -0.079950
  C      -1.288123     -0.460574      1.000485
  C      -1.606760     -0.843493      2.287703
  C      -2.124786     -2.133990      2.527217
  N      -2.516118     -2.601127      3.763602
  C      -2.091682     -2.053267      4.893796
  C      -0.818740     -1.410033      5.198847
  O      -0.629435     -0.665056      6.124385
  Cl      0.599677     -2.017420      4.223293
  C      -6.039621     -5.870517      4.601660
  C      -6.921783     -6.757201      5.260120
  C      -8.210362     -6.346025      5.557012
  C      -8.657325     -5.058236      5.202582
  C      -7.800234     -4.164417      4.581472
  C      -6.476468     -4.548699      4.297085
  N      -5.522275     -3.744635      3.677627
  C      -5.767043     -2.422859      3.636499
  C      -5.274081     -1.558463      2.595544
  O      -4.936769     -1.850226      1.472234
  Cl     -5.284197      0.174207      3.133104
  C      -1.251780     -5.020033      5.582759
  C       0.055168     -5.228471      6.087739
  C       0.355193     -4.840124      7.378530
  C      -0.620943     -4.222916      8.195632
  C      -1.908611     -4.037728      7.736325
  C      -2.258210     -4.473521      6.438536
  N      -3.509931     -4.357090      5.870901
  C      -4.612630     -4.155777      6.625802
  C      -4.861076     -4.808282      7.886058
  O      -4.222904     -5.654038      8.467992
  Cl     -6.476277     -4.257670      8.552688
  H      -2.346255     -3.198105     -0.742283
  H      -1.267463     -1.023458     -1.093624
  H      -0.890848      0.537231      0.814945
  H      -1.497212     -0.140704      3.112620
  H      -2.733940     -2.140359      5.768065
  H      -6.593159     -7.753629      5.550318
  H      -8.886267     -7.031776      6.068802
  H      -9.684883     -4.761843      5.413449
  H      -8.166045     -3.182544      4.282839
  H      -6.458609     -1.973527      4.353256
  H       0.831071     -5.649002      5.450280
  H       1.368573     -4.972923      7.758695
  H      -0.348393     -3.872444      9.191230
  H      -2.648934     -3.534486      8.355894
  H      -5.447598     -3.618492      6.190478
  N      -7.175618     -5.714064      1.383588
  N      -8.347757     -5.796051      1.307662
  H      -8.787796     -6.401441      0.545872
74
Coordinates from ORCA-job orca E -7353.003065384381
  N      -3.126554     -4.131417      1.750636
  C      -3.568114     -5.019586      0.680262
  C      -3.796646     -6.404950      1.276569
  N      -2.954872     -6.530873      2.495455
  C      -3.281057     -7.783239      3.247380
  C      -4.184454     -7.454678      4.438262
  N      -4.780308     -6.150518      4.189279
  Mo     -3.497829     -4.670134      3.686783
  N      -1.659252     -5.294557      4.316052
  C      -0.755796     -6.065012      3.458021
  C      -1.501102     -6.448976      2.188754
  H      -0.417343     -6.954411      4.014654
  H       0.141980     -5.480353      3.200516
  H      -1.152217     -7.414223      1.790076
  H      -1.349864     -5.693334      1.413485
  H      -4.951238     -8.231785      4.556287
  H      -3.603428     -7.416356      5.374072
  H      -3.771561     -8.479415      2.553743
  H      -2.349142     -8.249526      3.586346
  H      -2.811694     -5.063613     -0.116965
  H      -4.499535     -4.637091      0.232778
  H      -3.546714     -7.202470      0.558391
  H      -4.837125     -6.526061      1.598996
  C      -2.452376     -2.996208      1.428976
  C      -2.104934     -2.588121      0.117862
  C      -1.512684     -1.355303     -0.080005
  C      -1.290272     -0.471710      0.998967
  C      -1.611222     -0.851824      2.286276
  C      -2.126892     -2.142910      2.528428
  N      -2.521850     -2.606704      3.764890
  C      -2.109637     -2.055009      4.897349
  C      -0.843876     -1.400316      5.211213
  O      -0.670533     -0.647729      6.133604
  Cl      0.588937     -2.004769      4.256279
  C      -6.052406     -5.868756      4.588031
  C      -6.944129     -6.754513      5.234210
  C      -8.230241     -6.334687      5.530726
  C      -8.664616     -5.039660      5.188178
  C      -7.798257     -4.147152      4.577576
  C      -6.477400     -4.540825      4.293081
  N      -5.514746     -3.741081      3.681849
  C      -5.747254     -2.415740      3.652916
  C      -5.254557     -1.548941      2.614880
  O      -4.923445     -1.834987      1.488346
  Cl     -5.250642      0.181561      3.164194
  C      -1.242191     -5.009207      5.578093
  C       0.069779     -5.199364      6.076031
  C       0.372668     -4.799930      7.362987
  C      -0.605956     -4.189601      8.182185
  C      -1.898624     -4.022910      7.729355
  C      -2.249990     -4.470947      6.436449
  N      -3.506322     -4.375369      5.873238
  C      -4.610476     -4.192077      6.631158
  C      -4.850272     -4.853755      7.888315
  O      -4.199612     -5.691793      8.467885
  Cl     -6.470964     -4.324944      8.559172
  H      -2.340857     -3.215045     -0.739451
  H      -1.264041     -1.038667     -1.093705
  H      -0.894809      0.526484      0.811593
  H      -1.505209     -0.146758      3.109535
  H      -2.759127     -2.143265      5.766135
  H      -6.625727     -7.756851      5.515239
  H      -8.914068     -7.019494      6.033187
  H      -9.690197     -4.736747      5.399532
  H      -8.153463     -3.159172      4.286434
  H      -6.430165     -1.967248      4.378388
  H       0.847322     -5.613290      5.436152
  H       1.390089     -4.917653      7.737260
  H      -0.331926     -3.830108      9.174144
  H      -2.641591     -3.524729      8.349644
  H      -5.453701     -3.665991      6.198024
  N      -7.175034     -5.717986      1.397912
  N      -8.346734     -5.762608      1.337222
  H      -8.812751     -6.356576      0.581654
74
Coordinates from ORCA-job orca E -7353.003224540910
  N      -3.125848     -4.141593      1.752448
  C      -3.567076     -5.031817      0.683811
  C      -3.794126     -6.417197      1.282147
  N      -2.952826     -6.537884      2.502220
  C      -3.274689     -7.787022      3.258543
  C      -4.208969     -7.463113      4.427177
  N      -4.791720     -6.152763      4.178798
  Mo     -3.497497     -4.678578      3.690467
  N      -1.652717     -5.291287      4.312705
  C      -0.749614     -6.061710      3.454409
  C      -1.499350     -6.457417      2.191308
  H      -0.403332     -6.945677      4.014874
  H       0.143803     -5.474239      3.188234
  H      -1.151428     -7.426212      1.800437
  H      -1.350485     -5.709269      1.408478
  H      -4.984544     -8.235531      4.515828
  H      -3.653931     -7.439342      5.379296
  H      -3.735859     -8.499767      2.561385
  H      -2.342164     -8.231735      3.623629
  H      -2.811500     -5.076494     -0.114131
  H      -4.499241     -4.651238      0.236319
  H      -3.540522     -7.215936      0.566763
  H      -4.834201     -6.537920      1.601580
  C      -2.450025     -3.008062      1.430171
  C      -2.098882     -2.603471      0.118618
  C      -1.507908     -1.370680     -0.081635
  C      -1.290502     -0.482721      0.994954
  C      -1.614570     -0.858928      2.282321
  C      -2.127835     -2.150516      2.528068
  N      -2.526825     -2.609381      3.764589
  C      -2.129309     -2.051002      4.898059
  C      -0.876979     -1.372011      5.218741
  O      -0.725745     -0.611356      6.138177
  Cl      0.572738     -1.947250      4.273107
  C      -6.064604     -5.866313      4.572886
  C      -6.965379     -6.751266      5.207039
  C      -8.249861     -6.324360      5.501626
  C      -8.673032     -5.023295      5.168937
  C      -7.797544     -4.131784      4.569489
  C      -6.478856     -4.533385      4.286785
  N      -5.507673     -3.737041      3.685316
  C      -5.730330     -2.409048      3.667859
  C      -5.237245     -1.539015      2.633558
  O      -4.911661     -1.819044      1.503862
  Cl     -5.221361      0.188806      3.194477
  C      -1.231602     -4.999892      5.572575
  C       0.083279     -5.177896      6.066073
  C       0.386138     -4.775845      7.352566
  C      -0.595902     -4.176103      8.175134
  C      -1.891626     -4.021282      7.726011
  C      -2.241085     -4.470542      6.433398
  N      -3.500324     -4.390985      5.873692
  C      -4.603398     -4.222687      6.637445
  C      -4.824464     -4.884503      7.897422
  O      -4.155597     -5.709214      8.475521
  Cl     -6.453983     -4.388020      8.572294
  H      -2.331569     -3.233717     -0.737110
  H      -1.256723     -1.056838     -1.095589
  H      -0.896722      0.515660      0.805101
  H      -1.513060     -0.150308      3.103061
  H      -2.784538     -2.144975      5.761977
  H      -6.655976     -7.758417      5.480765
  H      -8.941074     -7.008502      5.994824
  H      -9.697271     -4.714812      5.378834
  H      -8.143561     -3.138641      4.284738
  H      -6.407455     -1.962515      4.399909
  H       0.862590     -5.584938      5.423892
  H       1.405650     -4.884427      7.723870
  H      -0.322820     -3.816182      9.167204
  H      -2.639036     -3.533243      8.349438
  H      -5.457276     -3.709983      6.208275
  N      -7.171229     -5.727140      1.411989
  N      -8.345378     -5.731130      1.368977
  H      -8.845611     -6.311626      0.625405
74
Coordinates from ORCA-job orca E -7353.003346934423
  N      -3.123565     -4.149846      1.755499
  C      -3.560632     -5.040103      0.685160
  C      -3.789620     -6.424839      1.283191
  N      -2.954181     -6.543780      2.507384
  C      -3.273492     -7.791201      3.263760
  C      -4.231849     -7.478283      4.415178
  N      -4.795166     -6.157808      4.181989
  Mo     -3.495539     -4.685230      3.697263
  N      -1.645001     -5.290301      4.312897
  C      -0.746020     -6.065378      3.454685
  C      -1.499597     -6.466685      2.195650
  H      -0.397602     -6.946570      4.018356
  H       0.147086     -5.481037      3.180390
  H      -1.153713     -7.438200      1.809803
  H      -1.350218     -5.722917      1.408851
  H      -5.020349     -8.241056      4.468232
  H      -3.698733     -7.483476      5.380095
  H      -3.712527     -8.514020      2.562605
  H      -2.340796     -8.220757      3.646600
  H      -2.802639     -5.084558     -0.110411
  H      -4.491776     -4.659207      0.235956
  H      -3.530906     -7.223581      0.569771
  H      -4.834601     -6.544285      1.594982
  C      -2.450073     -3.015155      1.432864
  C      -2.097066     -2.611105      0.121270
  C      -1.510454     -1.376586     -0.079791
  C      -1.299152     -0.485914      0.995848
  C      -1.624753     -0.861061      2.282916
  C      -2.133331     -2.154351      2.530129
  N      -2.533900     -2.611605      3.766152
  C      -2.146414     -2.047718      4.900338
  C      -0.904754     -1.349762      5.223570
  O      -0.768359     -0.584067      6.141031
  Cl      0.556685     -1.905176      4.284702
  C      -6.069252     -5.868386      4.569609
  C      -6.976773     -6.752146      5.195671
  C      -8.261031     -6.320313      5.484845
  C      -8.676975     -5.016584      5.154428
  C      -7.794678     -4.126424      4.562259
  C      -6.476400     -4.533337      4.286596
  N      -5.497697     -3.742030      3.690297
  C      -5.717593     -2.412021      3.676022
  C      -5.236872     -1.542159      2.637043
  O      -4.917690     -1.818888      1.504971
  Cl     -5.220088      0.187372      3.201068
  C      -1.219850     -4.996673      5.571170
  C       0.096700     -5.169181      6.060871
  C       0.400655     -4.765390      7.346944
  C      -0.581952     -4.171039      8.172435
  C      -1.879689     -4.022049      7.726638
  C      -2.228468     -4.471463      6.434295
  N      -3.488431     -4.399411      5.876220
  C      -4.590975     -4.231493      6.639914
  C      -4.803359     -4.878299      7.909142
  O      -4.125981     -5.690649      8.494686
  Cl     -6.440594     -4.397217      8.574716
  H      -2.325414     -3.244353     -0.733349
  H      -1.257560     -1.062867     -1.093358
  H      -0.908764      0.513565      0.804760
  H      -1.528594     -0.150508      3.102580
  H      -2.803638     -2.147006      5.762275
  H      -6.672760     -7.761413      5.467719
  H      -8.958371     -7.002760      5.971801
  H      -9.701254     -4.705379      5.360129
  H      -8.133669     -3.130860      4.277470
  H      -6.387930     -1.967372      4.415300
  H       0.875851     -5.573594      5.416760
  H       1.421520     -4.869694      7.715778
  H      -0.307950     -3.811380      9.164350
  H      -2.629708     -3.540315      8.352165
  H      -5.448636     -3.728169      6.206544
  N      -7.171864     -5.717516      1.410256
  N      -8.341616     -5.687405      1.378522
  H      -8.860491     -6.263142      0.644966
74
Coordinates from ORCA-job orca E -7353.003490877012
  N      -3.125055     -4.157917      1.757194
  C      -3.562066     -5.049802      0.688397
  C      -3.788038     -6.435499      1.288354
  N      -2.952154     -6.549455      2.512085
  C      -3.265573     -7.794797      3.273061
  C      -4.255756     -7.487824      4.400612
  N      -4.806706     -6.161291      4.169475
  Mo     -3.497371     -4.692787      3.699609
  N      -1.641637     -5.288256      4.308675
  C      -0.741533     -6.060691      3.449939
  C      -1.498141     -6.471589      2.195885
  H      -0.385393     -6.937207      4.015969
  H       0.147050     -5.472410      3.169390
  H      -1.152246     -7.445193      1.815450
  H      -1.352657     -5.733075      1.403427
  H      -5.050744     -8.245313      4.422902
  H      -3.748902     -7.508420      5.379435
  H      -3.672957     -8.534031      2.569541
  H      -2.333940     -8.201949      3.681557
  H      -2.805183     -5.093659     -0.108225
  H      -4.494713     -4.671351      0.240161
  H      -3.525666     -7.234150      0.576159
  H      -4.832411     -6.555003      1.594303
  C      -2.448515     -3.025005      1.435684
  C      -2.090108     -2.623490      0.124536
  C      -1.501545     -1.390121     -0.076831
  C      -1.293573     -0.497105      0.997747
  C      -1.623707     -0.869643      2.284218
  C      -2.133252     -2.162480      2.532558
  N      -2.539357     -2.616046      3.767719
  C      -2.163540     -2.048750      4.903329
  C      -0.930747     -1.338340      5.235611
  O      -0.811673     -0.568101      6.151584
  Cl      0.544964     -1.886872      4.317581
  C      -6.080386     -5.866442      4.556845
  C      -6.994347     -6.748680      5.175683
  C      -8.275836     -6.310113      5.467545
  C      -8.682554     -5.001098      5.146862
  C      -7.793822     -4.112497      4.561784
  C      -6.478432     -4.526627      4.283674
  N      -5.493511     -3.738399      3.693446
  C      -5.705575     -2.406656      3.684916
  C      -5.220463     -1.536899      2.648340
  O      -4.902986     -1.812067      1.515360
  Cl     -5.203341      0.192785      3.214303
  C      -1.212237     -4.986284      5.563917
  C       0.107928     -5.143827      6.048062
  C       0.412828     -4.733217      7.331997
  C      -0.572288     -4.146985      8.159915
  C      -1.873635     -4.012505      7.719334
  C      -2.222579     -4.468973      6.429700
  N      -3.486087     -4.415325      5.875802
  C      -4.588954     -4.262884      6.643327
  C      -4.787657     -4.911300      7.913759
  O      -4.094053     -5.708850      8.500773
  Cl     -6.429092     -4.452428      8.585010
  H      -2.315687     -3.258283     -0.729699
  H      -1.244355     -1.078718     -1.090040
  H      -0.902446      0.501912      0.805839
  H      -1.531146     -0.156921      3.102360
  H      -2.826694     -2.151500      5.760144
  H      -6.697455     -7.761744      5.441268
  H      -8.978163     -6.991264      5.949118
  H      -9.704879     -4.684543      5.354168
  H      -8.125822     -3.112634      4.283876
  H      -6.373295     -1.961032      4.426005
  H       0.888516     -5.541929      5.401752
  H       1.436169     -4.826110      7.697006
  H      -0.297793     -3.782141      9.149800
  H      -2.626231     -3.537358      8.346700
  H      -5.456438     -3.775929      6.210749
  N      -7.168021     -5.725306      1.420210
  N      -8.339040     -5.659657      1.402692
  H      -8.888144     -6.223515      0.682033
74
Coordinates from ORCA-job orca E -7353.003633311284
  N      -3.126237     -4.164314      1.758468
  C      -3.562038     -5.058317      0.691078
  C      -3.785249     -6.444248      1.294456
  N      -2.947959     -6.552614      2.516820
  C      -3.253041     -7.796198      3.283618
  C      -4.278968     -7.498679      4.383672
  N      -4.815803     -6.165025      4.157633
  Mo     -3.498927     -4.698344      3.701469
  N      -1.638841     -5.286918      4.305281
  C      -0.736424     -6.054583      3.445760
  C      -1.494835     -6.472813      2.195668
  H      -0.373047     -6.927484      4.012674
  H       0.147742     -5.461514      3.161327
  H      -1.148603     -7.447550      1.818584
  H      -1.354091     -5.737707      1.399250
  H      -5.080104     -8.249829      4.369196
  H      -3.802222     -7.538679      5.376873
  H      -3.622936     -8.553797      2.578435
  H      -2.323078     -8.176216      3.720308
  H      -2.805267     -5.101603     -0.105691
  H      -4.495732     -4.682577      0.242704
  H      -3.520433     -7.243186      0.583397
  H      -4.829898     -6.563215      1.594928
  C      -2.448142     -3.032139      1.438500
  C      -2.085129     -2.632212      0.128000
  C      -1.495695     -1.399316     -0.073091
  C      -1.291569     -0.504456      1.000888
  C      -1.625722     -0.875509      2.286700
  C      -2.135125     -2.168432      2.535235
  N      -2.544183     -2.620926      3.769782
  C      -2.175316     -2.051649      4.906458
  C      -0.948488     -1.333494      5.244752
  O      -0.840829     -0.560939      6.160274
  Cl      0.535802     -1.875373      4.338740
  C      -6.088867     -5.865552      4.545823
  C      -7.006959     -6.746947      5.159929
  C      -8.286098     -6.303903      5.455362
  C      -8.686392     -4.990932      5.142723
  C      -7.793617     -4.103280      4.562307
  C      -6.480448     -4.522182      4.280913
  N      -5.491161     -3.735698      3.695304
  C      -5.699363     -2.402984      3.687910
  C      -5.214730     -1.535746      2.649353
  O      -4.898363     -1.813269      1.516521
  Cl     -5.198936      0.195879      3.210776
  C      -1.206549     -4.981102      5.558787
  C       0.116161     -5.129387      6.038407
  C       0.422597     -4.714072      7.320584
  C      -0.562849     -4.131358      8.150066
  C      -1.866826     -4.006049      7.714006
  C      -2.217490     -4.469292      6.427336
  N      -3.483772     -4.428057      5.876636
  C      -4.586929     -4.283740      6.645804
  C      -4.779725     -4.930625      7.918219
  O      -4.079916     -5.721122      8.507356
  Cl     -6.420440     -4.475405      8.593459
  H      -2.307645     -3.268056     -0.726319
  H      -1.234818     -1.089551     -1.085865
  H      -0.900484      0.494521      0.808769
  H      -1.536914     -0.161123      3.103743
  H      -2.841388     -2.157824      5.760491
  H      -6.714637     -7.762612      5.420572
  H      -8.991354     -6.984179      5.933855
  H      -9.706933     -4.670339      5.352624
  H      -8.121337     -3.100253      4.290997
  H      -6.364882     -1.955016      4.429516
  H       0.897156     -5.523283      5.390043
  H       1.447675     -4.799809      7.682497
  H      -0.286845     -3.761792      9.137776
  H      -2.619407     -3.532913      8.342511
  H      -5.459972     -3.808834      6.211617
  N      -7.164404     -5.726213      1.432091
  N      -8.334296     -5.628549      1.427323
  H      -8.909297     -6.183066      0.719460
74
Coordinates from ORCA-job orca E -7353.003798577854
  N      -3.126905     -4.167954      1.758368
  C      -3.560718     -5.064437      0.691654
  C      -3.781407     -6.449990      1.299594
  N      -2.942639     -6.552136      2.520540
  C      -3.237865     -7.794391      3.293668
  C      -4.300745     -7.510318      4.363595
  N      -4.821259     -6.168278      4.147821
  Mo     -3.500811     -4.700982      3.701642
  N      -1.637242     -5.285523      4.302883
  C      -0.731539     -6.047413      3.442820
  C      -1.490395     -6.470418      2.195161
  H      -0.362083     -6.917904      4.009415
  H       0.148858     -5.449321      3.157159
  H      -1.144307     -7.445690      1.819426
  H      -1.353950     -5.737074      1.396520
  H      -5.107646     -8.253289      4.307381
  H      -3.856232     -7.574370      5.370267
  H      -3.566317     -8.570459      2.587491
  H      -2.310309     -8.143665      3.759301
  H      -2.803225     -5.107241     -0.104459
  H      -4.495043     -4.691123      0.242697
  H      -3.514324     -7.249380      0.589688
  H      -4.827588     -6.569637      1.594685
  C      -2.448316     -3.035780      1.440342
  C      -2.081739     -2.636513      0.130652
  C      -1.492431     -1.403415     -0.069643
  C      -1.292406     -0.507322      1.004198
  C      -1.629705     -0.878163      2.289375
  C      -2.137815     -2.171693      2.537187
  N      -2.547559     -2.625507      3.771486
  C      -2.180538     -2.054993      4.908364
  C      -0.955146     -1.336423      5.249792
  O      -0.852003     -0.561464      6.164057
  Cl      0.532346     -1.879703      4.351197
  C      -6.092896     -5.864827      4.539708
  C      -7.011230     -6.745746      5.154467
  C      -8.288004     -6.300584      5.456571
  C      -8.685667     -4.985441      5.149389
  C      -7.792663     -4.098505      4.568196
  C      -6.481604     -4.519642      4.280352
  N      -5.491354     -3.733934      3.694509
  C      -5.700104     -2.401263      3.682622
  C      -5.216640     -1.538828      2.639529
  O      -4.899603     -1.822532      1.508201
  Cl     -5.206209      0.196172      3.189623
  C      -1.204097     -4.979195      5.555873
  C       0.119962     -5.123822      6.033220
  C       0.427246     -4.707350      7.314758
  C      -0.557773     -4.125837      8.145149
  C      -1.863104     -4.004319      7.711805
  C      -2.215402     -4.470952      6.426785
  N      -3.483385     -4.435842      5.877816
  C      -4.587020     -4.294904      6.646513
  C      -4.778895     -4.937184      7.922050
  O      -4.078498     -5.723911      8.515224
  Cl     -6.417495     -4.475840      8.597949
  H      -2.301289     -3.272478     -0.724432
  H      -1.228896     -1.094640     -1.082031
  H      -0.902214      0.492079      0.812557
  H      -1.544571     -0.162580      3.105709
  H      -2.847190     -2.162113      5.761755
  H      -6.719825     -7.762447      5.412179
  H      -8.992914     -6.980125      5.936570
  H      -9.704238     -4.662009      5.364466
  H      -8.120120     -3.093956      4.302605
  H      -6.365209     -1.949054      4.421948
  H       0.900965     -5.515133      5.383401
  H       1.453004     -4.790527      7.675418
  H      -0.280500     -3.753873      9.131598
  H      -2.614197     -3.530819      8.341374
  H      -5.463460     -3.830632      6.208468
  N      -7.162265     -5.722850      1.437295
  N      -8.329504     -5.598476      1.441630
  H      -8.924983     -6.147680      0.746276
74
Coordinates from ORCA-job orca E -7353.003989536770
  N      -3.126943     -4.170497      1.758394
  C      -3.559548     -5.068839      0.691624
  C      -3.778398     -6.453721      1.303471
  N      -2.938937     -6.550089      2.523910
  C      -3.225653     -7.791162      3.302040
  C      -4.322798     -7.523167      4.341033
  N      -4.823971     -6.171130      4.142373
  Mo     -3.503094     -4.702704      3.701821
  N      -1.636231     -5.285018      4.302338
  C      -0.727788     -6.042120      3.441517
  C      -1.487240     -6.468463      2.195583
  H      -0.352899     -6.910832      4.007218
  H       0.149373     -5.439608      3.155126
  H      -1.142805     -7.444573      1.820524
  H      -1.353243     -5.736601      1.395337
  H      -5.136122     -8.254265      4.238931
  H      -3.912052     -7.617563      5.359572
  H      -3.514213     -8.582556      2.595045
  H      -2.301506     -8.110767      3.794617
  H      -2.801565     -5.111469     -0.103970
  H      -4.494261     -4.696461      0.243017
  H      -3.508602     -7.253602      0.594915
  H      -4.826404     -6.576409      1.594569
  C      -2.448011     -3.038440      1.442087
  C      -2.079183     -2.639284      0.133066
  C      -1.490273     -1.405758     -0.066342
  C      -1.293058     -0.509251      1.007694
  C      -1.632344     -0.880553      2.292439
  C      -2.139599     -2.174469      2.539176
  N      -2.549157     -2.630234      3.773556
  C      -2.181604     -2.057504      4.909468
  C      -0.956824     -1.338173      5.249645
  O      -0.853536     -0.563083      6.164006
  Cl      0.530279     -1.881645      4.350717
  C      -6.094573     -5.864918      4.536987
  C      -7.011559     -6.746358      5.153133
  C      -8.287235     -6.301517      5.460209
  C      -8.684667     -4.985698      5.155687
  C      -7.792811     -4.098601      4.572694
  C      -6.482779     -4.519489      4.280049
  N      -5.492879     -3.733504      3.693092
  C      -5.704164     -2.401394      3.676571
  C      -5.221146     -1.542190      2.630389
  O      -4.902185     -1.831061      1.500626
  Cl     -5.214188      0.194667      3.171489
  C      -1.202906     -4.978252      5.554796
  C       0.122164     -5.121286      6.030828
  C       0.430551     -4.703844      7.311581
  C      -0.553643     -4.121800      8.142439
  C      -1.859804     -4.002252      7.711138
  C      -2.213970     -4.471641      6.427613
  N      -3.483200     -4.439909      5.880654
  C      -4.586128     -4.299368      6.649137
  C      -4.777989     -4.935146      7.928655
  O      -4.079653     -5.720434      8.525716
  Cl     -6.414829     -4.465557      8.603414
  H      -2.296714     -3.274481     -0.723165
  H      -1.225411     -1.097572     -1.078565
  H      -0.903584      0.490588      0.816976
  H      -1.549145     -0.164381      3.108475
  H      -2.846515     -2.164989      5.764289
  H      -6.718896     -7.763134      5.409268
  H      -8.990621     -6.981117      5.942300
  H      -9.701937     -4.660816      5.374725
  H      -8.122512     -3.093809      4.311138
  H      -6.369871     -1.945961      4.413262
  H       0.902741     -5.511392      5.379882
  H       1.456684     -4.785904      7.671504
  H      -0.275087     -3.747597      9.127677
  H      -2.608707     -3.527097      8.341804
  H      -5.465221     -3.843629      6.207976
  N      -7.160078     -5.717060      1.437733
  N      -8.323716     -5.569747      1.448722
  H      -8.936451     -6.115912      0.766010
74
Coordinates from ORCA-job orca E -7353.004227934247
  N      -3.125374     -4.172701      1.757757
  C      -3.557255     -5.072724      0.690718
  C      -3.774581     -6.456526      1.305339
  N      -2.935385     -6.548044      2.526202
  C      -3.216637     -7.787527      3.307528
  C      -4.345508     -7.537265      4.313800
  N      -4.823496     -6.173301      4.140417
  Mo     -3.503956     -4.704163      3.701229
  N      -1.634333     -5.285062      4.303785
  C      -0.723509     -6.038432      3.442080
  C      -1.483642     -6.468094      2.197254
  H      -0.343051     -6.905359      4.006750
  H       0.150337     -5.431555      3.154757
  H      -1.141408     -7.445409      1.823272
  H      -1.349862     -5.738000      1.395457
  H      -5.166543     -8.250793      4.159776
  H      -3.972449     -7.671083      5.342552
  H      -3.468394     -8.590680      2.599553
  H      -2.297329     -8.080423      3.825451
  H      -2.799334     -5.115399     -0.104842
  H      -4.492204     -4.700536      0.242832
  H      -3.502510     -7.257306      0.598478
  H      -4.823880     -6.583943      1.595405
  C      -2.447116     -3.040561      1.442113
  C      -2.078526     -2.641026      0.133244
  C      -1.492700     -1.405861     -0.065966
  C      -1.298777     -0.508842      1.008087
  C      -1.637594     -0.881242      2.292914
  C      -2.140895     -2.176511      2.539375
  N      -2.548802     -2.634869      3.774384
  C      -2.180623     -2.058374      4.908717
  C      -0.955174     -1.339923      5.246579
  O      -0.849815     -0.562059      6.158478
  Cl      0.530701     -1.884938      4.345143
  C      -6.092787     -5.864578      4.538362
  C      -7.007259     -6.746856      5.156855
  C      -8.282222     -6.303207      5.469007
  C      -8.680538     -4.987467      5.165912
  C      -7.790795     -4.100026      4.579713
  C      -6.481540     -4.519724      4.282253
  N      -5.494111     -3.734026      3.690627
  C      -5.708025     -2.402809      3.669681
  C      -5.226141     -1.545869      2.620721
  O      -4.906536     -1.839291      1.492019
  Cl     -5.218708      0.191594      3.154954
  C      -1.202667     -4.977969      5.556176
  C       0.122723     -5.120370      6.033005
  C       0.430766     -4.703907      7.313889
  C      -0.553995     -4.123139      8.145233
  C      -1.860049     -4.004433      7.713837
  C      -2.213966     -4.472671      6.429845
  N      -3.483185     -4.440485      5.884033
  C      -4.584839     -4.298750      6.651763
  C      -4.775826     -4.924908      7.936727
  O      -4.078929     -5.707241      8.538764
  Cl     -6.414439     -4.452638      8.606090
  H      -2.294399     -3.275678     -0.723822
  H      -1.228834     -1.097618     -1.078433
  H      -0.912337      0.492292      0.818024
  H      -1.556421     -0.164396      3.108559
  H      -2.844445     -2.163528      5.764859
  H      -6.712323     -7.763358      5.411582
  H      -8.983277     -6.983254      5.953821
  H      -9.696666     -4.661608      5.388816
  H      -8.123927     -3.095707      4.320798
  H      -6.373787     -1.944881      4.404705
  H       0.903656     -5.508993      5.381663
  H       1.456759     -4.785699      7.674306
  H      -0.275948     -3.749055      9.130655
  H      -2.608045     -3.529514      8.345922
  H      -5.466246     -3.849648      6.208065
  N      -7.155486     -5.708477      1.434534
  N      -8.314742     -5.541497      1.450106
  H      -8.941687     -6.085650      0.779179
74
Coordinates from ORCA-job orca E -7353.004504810410
  N      -3.125028     -4.176886      1.757966
  C      -3.557011     -5.078876      0.691505
  C      -3.770683     -6.462461      1.306718
  N      -2.932435     -6.549097      2.528824
  C      -3.209330     -7.785044      3.313752
  C      -4.369492     -7.551008      4.283860
  N      -4.824507     -6.175337      4.137979
  Mo     -3.503551     -4.707620      3.701368
  N      -1.631419     -5.284804      4.306391
  C      -0.718644     -6.033958      3.442670
  C      -1.480550     -6.469740      2.200074
  H      -0.329889     -6.897741      4.006454
  H       0.149946     -5.421292      3.151723
  H      -1.138604     -7.448499      1.829461
  H      -1.346871     -5.743000      1.395188
  H      -5.196624     -8.244051      4.075147
  H      -4.039273     -7.727433      5.321151
  H      -3.424232     -8.600300      2.607389
  H      -2.297230     -8.050626      3.859070
  H      -2.800906     -5.120739     -0.105721
  H      -4.493179     -4.707963      0.245333
  H      -3.495946     -7.263965      0.601690
  H      -4.819861     -6.595794      1.598434
  C      -2.447557     -3.044926      1.441232
  C      -2.080850     -2.645206      0.131948
  C      -1.497506     -1.408839     -0.067696
  C      -1.304015     -0.511996      1.006361
  C      -1.640585     -0.884942      2.291739
  C      -2.141779     -2.180700      2.538805
  N      -2.548168     -2.640084      3.774571
  C      -2.180113     -2.060146      4.907558
  C      -0.955932     -1.337580      5.240764
  O      -0.847465     -0.562966      6.154988
  Cl      0.528010     -1.874888      4.329820
  C      -6.092802     -5.863928      4.537611
  C      -7.007328     -6.747546      5.153497
  C      -8.281941     -6.303985      5.468386
  C      -8.678720     -4.987189      5.169239
  C      -7.788535     -4.098879      4.584323
  C      -6.479826     -4.518443      4.284629
  N      -5.493714     -3.733432      3.690682
  C      -5.705810     -2.402470      3.671421
  C      -5.224394     -1.544346      2.622915
  O      -4.907754     -1.837587      1.493198
  Cl     -5.209169      0.191145      3.159718
  C      -1.201611     -4.975205      5.558263
  C       0.124403     -5.113017      6.035650
  C       0.431707     -4.695700      7.316250
  C      -0.555132     -4.118610      8.148279
  C      -1.861228     -4.004243      7.716384
  C      -2.213589     -4.472275      6.431950
  N      -3.482650     -4.441767      5.887875
  C      -4.582423     -4.300920      6.656128
  C      -4.769384     -4.919651      7.945415
  O      -4.070327     -5.697675      8.550180
  Cl     -6.412138     -4.454033      8.610384
  H      -2.296654     -3.279966     -0.725001
  H      -1.235519     -1.100277     -1.080555
  H      -0.919367      0.489871      0.816453
  H      -1.558377     -0.168123      3.107328
  H      -2.842195     -2.165255      5.765355
  H      -6.712460     -7.765114      5.404049
  H      -8.982999     -6.985100      5.951686
  H      -9.694057     -4.660109      5.394035
  H      -8.122113     -3.093854      4.328566
  H      -6.370106     -1.944680      4.407904
  H       0.906636     -5.498941      5.384193
  H       1.458081     -4.774029      7.676311
  H      -0.278774     -3.743957      9.133949
  H      -2.610586     -3.532260      8.349471
  H      -5.466358     -3.855293      6.213012
  N      -7.150279     -5.702786      1.435048
  N      -8.305604     -5.517720      1.455535
  H      -8.946472     -6.057715      0.795194
74
Coordinates from ORCA-job orca E -7353.004488224373
  N      -3.126155     -4.183404      1.757542
  C      -3.556872     -5.087135      0.691367
  C      -3.765391     -6.470682      1.307716
  N      -2.929013     -6.550479      2.532853
  C      -3.197948     -7.783597      3.322968
  C      -4.397768     -7.565094      4.259082
  N      -4.829768     -6.177943      4.133775
  Mo     -3.504479     -4.711614      3.703467
  N      -1.627121     -5.282099      4.307091
  C      -0.712831     -6.027642      3.441939
  C      -1.477211     -6.470845      2.202597
  H      -0.315672     -6.887971      4.006379
  H       0.150986     -5.409830      3.145644
  H      -1.135623     -7.451585      1.836209
  H      -1.345209     -5.747968      1.393475
  H      -5.235121     -8.242488      3.997598
  H      -4.107392     -7.778154      5.311767
  H      -3.372238     -8.617988      2.613905
  H      -2.286648     -8.018336      3.900245
  H      -2.801778     -5.127413     -0.106884
  H      -4.494533     -4.718144      0.247142
  H      -3.482775     -7.272158      0.605414
  H      -4.818489     -6.613340      1.597559
  C      -2.448225     -3.052254      1.439721
  C      -2.081077     -2.653961      0.129898
  C      -1.498831     -1.417288     -0.071410
  C      -1.307243     -0.518752      1.001398
  C      -1.644213     -0.890244      2.287221
  C      -2.143390     -2.186404      2.536414
  N      -2.550593     -2.644416      3.772803
  C      -2.188855     -2.059097      4.906055
  C      -0.968311     -1.330951      5.243250
  O      -0.867092     -0.550757      6.154953
  Cl      0.523619     -1.863962      4.339054
  C      -6.097467     -5.863494      4.534121
  C      -7.014976     -6.748371      5.144837
  C      -8.288196     -6.301730      5.462531
  C      -8.679869     -4.981057      5.170154
  C      -7.786439     -4.092057      4.589077
  C      -6.479354     -4.515257      4.287468
  N      -5.490838     -3.732398      3.694429
  C      -5.699361     -2.399376      3.677869
  C      -5.222216     -1.541675      2.626874
  O      -4.910369     -1.835792      1.495750
  Cl     -5.200150      0.195455      3.164154
  C      -1.196246     -4.969941      5.557996
  C       0.132038     -5.101167      6.033577
  C       0.439285     -4.682982      7.313905
  C      -0.549920     -4.111709      8.147865
  C      -1.857908     -4.003804      7.717745
  C      -2.209378     -4.472272      6.433397
  N      -3.480078     -4.447552      5.891004
  C      -4.580645     -4.312950      6.660550
  C      -4.761587     -4.928238      7.954075
  O      -4.054687     -5.699473      8.561578
  Cl     -6.412201     -4.475666      8.616794
  H      -2.296129     -3.289915     -0.726309
  H      -1.236847     -1.109863     -1.084725
  H      -0.923860      0.483403      0.810276
  H      -1.563626     -0.171817      3.101415
  H      -2.854557     -2.161778      5.761217
  H      -6.723462     -7.769183      5.389757
  H      -8.991762     -6.983636      5.942314
  H      -9.693978     -4.651104      5.396791
  H      -8.116585     -3.084004      4.337933
  H      -6.358538     -1.940952      4.418876
  H       0.915518     -5.482934      5.380715
  H       1.467131     -4.756422      7.672539
  H      -0.274084     -3.736490      9.133426
  H      -2.609443     -3.536545      8.352518
  H      -5.470038     -3.875680      6.217254
  N      -7.138704     -5.701840      1.437881
  N      -8.292280     -5.476652      1.467729
  H      -8.955773     -6.012656      0.817862
74
Coordinates from ORCA-job orca E -7353.004719142714
  N      -3.128669     -4.186325      1.761460
  C      -3.558635     -5.086417      0.698968
  C      -3.764664     -6.473120      1.302012
  N      -2.932391     -6.554877      2.533504
  C      -3.199078     -7.779965      3.331059
  C      -4.406362     -7.569462      4.239087
  N      -4.825583     -6.174704      4.143309
  Mo     -3.502947     -4.712615      3.709346
  N      -1.623800     -5.276589      4.309474
  C      -0.713713     -6.025471      3.442731
  C      -1.480614     -6.473862      2.206855
  H      -0.313045     -6.882089      4.008219
  H       0.146278     -5.408550      3.138349
  H      -1.134882     -7.454885      1.845349
  H      -1.347382     -5.754202      1.395915
  H      -5.237581     -8.228739      3.944091
  H      -4.146299     -7.810500      5.282770
  H      -3.356950     -8.618875      2.642750
  H      -2.302479     -7.996515      3.920932
  H      -2.804276     -5.123236     -0.099173
  H      -4.495373     -4.716495      0.256666
  H      -3.471353     -7.269057      0.600035
  H      -4.816593     -6.626755      1.586427
  C      -2.450993     -3.057323      1.438060
  C      -2.088121     -2.661872      0.126309
  C      -1.505059     -1.426717     -0.079769
  C      -1.308783     -0.526709      0.989848
  C      -1.641966     -0.894416      2.276969
  C      -2.141456     -2.189361      2.532106
  N      -2.547450     -2.641632      3.768995
  C      -2.187160     -2.054931      4.900166
  C      -0.964973     -1.337006      5.239324
  O      -0.860728     -0.553991      6.141570
  Cl      0.526388     -1.881895      4.342366
  C      -6.093352     -5.863298      4.544216
  C      -7.012454     -6.751710      5.146059
  C      -8.286225     -6.305691      5.462452
  C      -8.676730     -4.984678      5.175638
  C      -7.781963     -4.092707      4.600901
  C      -6.474743     -4.515236      4.301738
  N      -5.490120     -3.735489      3.705536
  C      -5.694347     -2.402002      3.691181
  C      -5.226064     -1.548469      2.637366
  O      -4.922758     -1.843479      1.506029
  Cl     -5.196122      0.187603      3.177482
  C      -1.195338     -4.960537      5.559881
  C       0.131343     -5.086456      6.035968
  C       0.435173     -4.668221      7.316348
  C      -0.557080     -4.102519      8.150973
  C      -1.863170     -3.998846      7.719856
  C      -2.210396     -4.465868      6.434432
  N      -3.477716     -4.439508      5.891922
  C      -4.580918     -4.313269      6.660480
  C      -4.766980     -4.943753      7.943278
  O      -4.058018     -5.713805      8.543780
  Cl     -6.425868     -4.514362      8.604078
  H      -2.307494     -3.300836     -0.726191
  H      -1.246698     -1.120883     -1.094227
  H      -0.924568      0.474273      0.795058
  H      -1.557608     -0.175182      3.088841
  H      -2.856607     -2.144623      5.749671
  H      -6.723617     -7.774738      5.384181
  H      -8.991777     -6.991063      5.934867
  H      -9.691732     -4.657983      5.399854
  H      -8.107433     -3.083976      4.349477
  H      -6.345558     -1.944815      4.439928
  H       0.915863     -5.466355      5.383659
  H       1.462138     -4.737795      7.674210
  H      -0.285025     -3.728466      9.137384
  H      -2.618816     -3.537260      8.353802
  H      -5.464561     -3.871917      6.222082
  N      -7.107808     -5.703989      1.427129
  N      -8.258069     -5.426733      1.456796
  H      -8.940937     -5.959769      0.849229
74
Coordinates from ORCA-job orca E -7353.004746071533
  N      -3.136124     -4.193517      1.757914
  C      -3.576298     -5.100494      0.698396
  C      -3.767571     -6.491533      1.312944
  N      -2.930107     -6.556711      2.533955
  C      -3.187158     -7.779159      3.341817
  C      -4.422303     -7.573853      4.205944
  N      -4.835578     -6.178247      4.118720
  Mo     -3.507104     -4.720373      3.699099
  N      -1.628326     -5.280214      4.302304
  C      -0.711882     -6.013964      3.430995
  C      -1.478989     -6.471719      2.199308
  H      -0.297514     -6.866026      3.992272
  H       0.138827     -5.384775      3.125461
  H      -1.131549     -7.454019      1.844190
  H      -1.351584     -5.758261      1.381854
  H      -5.239370     -8.217760      3.879172
  H      -4.197141     -7.832013      5.241654
  H      -3.297766     -8.636151      2.666815
  H      -2.307222     -7.960424      3.962833
  H      -2.829501     -5.137490     -0.106858
  H      -4.520518     -4.734651      0.264868
  H      -3.471070     -7.290767      0.614679
  H      -4.801185     -6.652252      1.594380
  C      -2.448643     -3.067254      1.436311
  C      -2.077980     -2.672950      0.126322
  C      -1.487212     -1.440819     -0.076663
  C      -1.292415     -0.541347      0.993879
  C      -1.632624     -0.907546      2.279737
  C      -2.136759     -2.200746      2.532774
  N      -2.548333     -2.651646      3.768766
  C      -2.204241     -2.063125      4.903857
  C      -0.993520     -1.320338      5.258235
  O      -0.918467     -0.535616      6.170129
  Cl      0.524444     -1.833006      4.375410
  C      -6.101797     -5.859013      4.526421
  C      -7.021469     -6.744371      5.130058
  C      -8.290450     -6.293372      5.460113
  C      -8.676178     -4.969642      5.184638
  C      -7.781273     -4.080824      4.608543
  C      -6.478440     -4.507818      4.295615
  N      -5.491797     -3.724499      3.702123
  C      -5.686467     -2.392345      3.700331
  C      -5.184938     -1.525209      2.665008
  O      -4.877523     -1.809512      1.529714
  Cl     -5.137478      0.206554      3.229788
  C      -1.200139     -4.957580      5.550388
  C       0.127673     -5.074461      6.024768
  C       0.432798     -4.650025      7.303551
  C      -0.559190     -4.085372      8.137859
  C      -1.865988     -3.989716      7.708364
  C      -2.215971     -4.464019      6.424713
  N      -3.485740     -4.450967      5.886174
  C      -4.583053     -4.333916      6.660155
  C      -4.751567     -4.959792      7.945538
  O      -4.027640     -5.710655      8.552087
  Cl     -6.399185     -4.534585      8.618897
  H      -2.296071     -3.309149     -0.728537
  H      -1.221654     -1.136763     -1.090067
  H      -0.903541      0.457880      0.800647
  H      -1.550096     -0.187475      3.091688
  H      -2.885040     -2.170061      5.748739
  H      -6.733385     -7.767342      5.360915
  H      -8.995229     -6.975082      5.935722
  H      -9.687713     -4.637283      5.418803
  H      -8.106505     -3.069935      4.368320
  H      -6.349702     -1.937849      4.439959
  H       0.911973     -5.452461      5.372006
  H       1.460290     -4.713206      7.660379
  H      -0.286127     -3.705693      9.122847
  H      -2.620522     -3.529396      8.342673
  H      -5.478205     -3.910440      6.224660
  N      -7.131572     -5.711149      1.430171
  N      -8.267358     -5.469009      1.470773
  H      -8.961792     -5.989247      0.865408
74
Coordinates from ORCA-job orca E -7353.005377628859
  N      -3.133598     -4.193425      1.762746
  C      -3.569166     -5.102093      0.701017
  C      -3.760625     -6.491235      1.315998
  N      -2.925387     -6.554168      2.541431
  C      -3.182978     -7.773483      3.351657
  C      -4.451163     -7.587248      4.181791
  N      -4.839402     -6.180880      4.119948
  Mo     -3.507264     -4.721215      3.706142
  N      -1.625438     -5.277964      4.309086
  C      -0.706383     -6.009022      3.438462
  C      -1.473693     -6.471800      2.207992
  H      -0.287064     -6.858726      4.000718
  H       0.141410     -5.375831      3.131398
  H      -1.127926     -7.455686      1.855058
  H      -1.346697     -5.760518      1.388478
  H      -5.276407     -8.210090      3.797999
  H      -4.267978     -7.889160      5.228808
  H      -3.259380     -8.637181      2.676591
  H      -2.313856     -7.931762      3.995972
  H      -2.821184     -5.137489     -0.103799
  H      -4.513626     -4.738765      0.266097
  H      -3.460680     -7.290442      0.619185
  H      -4.803090     -6.655389      1.597020
  C      -2.451856     -3.064310      1.443013
  C      -2.083263     -2.667649      0.133251
  C      -1.496902     -1.432936     -0.068820
  C      -1.302879     -0.534603      1.002960
  C      -1.639677     -0.904676      2.288952
  C      -2.142474     -2.198886      2.539886
  N      -2.548197     -2.655180      3.776935
  C      -2.181392     -2.075305      4.907453
  C      -0.962399     -1.353651      5.235354
  O      -0.851666     -0.593086      6.148357
  Cl      0.511879     -1.878040      4.316187
  C      -6.106844     -5.861516      4.523722
  C      -7.029284     -6.751655      5.119257
  C      -8.299900     -6.303494      5.446288
  C      -8.683711     -4.977174      5.174637
  C      -7.786281     -4.084435      4.604525
  C      -6.481508     -4.508829      4.295364
  N      -5.493172     -3.725567      3.703511
  C      -5.692953     -2.393610      3.692361
  C      -5.208643     -1.536735      2.642092
  O      -4.898810     -1.832616      1.510800
  Cl     -5.185127      0.198800      3.176507
  C      -1.194828     -4.952377      5.556804
  C       0.136526     -5.063699      6.029348
  C       0.445029     -4.633341      7.306430
  C      -0.547053     -4.068922      8.140943
  C      -1.857597     -3.980013      7.713954
  C      -2.209862     -4.459610      6.432332
  N      -3.483736     -4.453349      5.895303
  C      -4.582451     -4.337610      6.668580
  C      -4.745625     -4.951482      7.963799
  O      -4.018105     -5.700559      8.576566
  Cl     -6.403689     -4.529799      8.628146
  H      -2.299699     -3.303469     -0.722578
  H      -1.233626     -1.127109     -1.082307
  H      -0.916839      0.466338      0.811146
  H      -1.556635     -0.186003      3.102251
  H      -2.841394     -2.183111      5.768355
  H      -6.742393     -7.777146      5.346138
  H      -9.006552     -6.988949      5.916554
  H      -9.695933     -4.645522      5.406851
  H      -8.111783     -3.072307      4.367113
  H      -6.354059     -1.935534      4.432003
  H       0.921312     -5.439453      5.375253
  H       1.475552     -4.690930      7.661611
  H      -0.271798     -3.684164      9.124041
  H      -2.611787     -3.519006      8.348830
  H      -5.484814     -3.922236      6.227559
  N      -7.121423     -5.696150      1.436548
  N      -8.254220     -5.421046      1.486399
  H      -8.966729     -5.948283      0.891063
74
Coordinates from ORCA-job orca E -7353.003773959949
  N      -3.130493     -4.199258      1.762933
  C      -3.563759     -5.103163      0.701200
  C      -3.753704     -6.490807      1.304796
  N      -2.921816     -6.559286      2.540728
  C      -3.181017     -7.773107      3.353692
  C      -4.458458     -7.591519      4.179883
  N      -4.834565     -6.181899      4.134573
  Mo     -3.496109     -4.720974      3.713326
  N      -1.614230     -5.277745      4.313057
  C      -0.698824     -6.010508      3.438825
  C      -1.470799     -6.475962      2.209939
  H      -0.274662     -6.860478      4.001329
  H       0.146950     -5.375617      3.123822
  H      -1.122981     -7.460838      1.859552
  H      -1.343249     -5.765117      1.388954
  H      -5.293760     -8.202400      3.777075
  H      -4.285823     -7.914802      5.232637
  H      -3.256254     -8.645659      2.675851
  H      -2.305581     -7.924266      4.009306
  H      -2.817709     -5.134406     -0.105334
  H      -4.507562     -4.741072      0.269463
  H      -3.449246     -7.285482      0.605069
  H      -4.815349     -6.663834      1.599615
  C      -2.447848     -3.073824      1.434743
  C      -2.085473     -2.683017      0.121511
  C      -1.502294     -1.448373     -0.088197
  C      -1.306237     -0.545143      0.979940
  C      -1.638296     -0.909341      2.269035
  C      -2.137313     -2.203919      2.527197
  N      -2.547866     -2.650817      3.764529
  C      -2.216230     -2.041744      4.899706
  C      -1.010364     -1.276215      5.254998
  O      -0.945787     -0.463129      6.161486
  Cl      0.526148     -1.800924      4.392128
  C      -6.100635     -5.865429      4.536603
  C      -7.026832     -6.760855      5.120022
  C      -8.297904     -6.310308      5.442736
  C      -8.678594     -4.978713      5.176634
  C      -7.778160     -4.082526      4.613077
  C      -6.472040     -4.509927      4.311247
  N      -5.482935     -3.732346      3.717724
  C      -5.683017     -2.397397      3.703940
  C      -5.230882     -1.552296      2.638569
  O      -4.929545     -1.853177      1.509493
  Cl     -5.210474      0.183597      3.160990
  C      -1.182785     -4.965523      5.562594
  C       0.147338     -5.089607      6.032226
  C       0.455965     -4.673618      7.311776
  C      -0.534204     -4.110165      8.150724
  C      -1.843232     -4.007794      7.724575
  C      -2.195280     -4.474598      6.440832
  N      -3.466413     -4.448808      5.901219
  C      -4.566957     -4.320119      6.671586
  C      -4.752694     -4.944301      7.959874
  O      -4.059996     -5.727096      8.554054
  Cl     -6.395173     -4.493453      8.628043
  H      -2.306042     -3.325636     -0.728760
  H      -1.243423     -1.144780     -1.103470
  H      -0.922713      0.455855      0.782000
  H      -1.554558     -0.187621      3.080573
  H      -2.905588     -2.127788      5.733203
  H      -6.744734     -7.793267      5.337805
  H      -9.008914     -6.999353      5.904027
  H      -9.691841     -4.648304      5.406163
  H      -8.096047     -3.066072      4.374127
  H      -6.331077     -1.938424      4.454430
  H       0.931082     -5.465647      5.375219
  H       1.485564     -4.741930      7.664486
  H      -0.258899     -3.737757      9.136092
  H      -2.598734     -3.548026      8.360753
  H      -5.449251     -3.872239      6.235396
  N      -7.106282     -5.689460      1.447206
  N      -8.245848     -5.350238      1.486760
  H      -8.968527     -5.893778      0.889508
74
Coordinates from ORCA-job orca E -7353.006105949281
  N      -3.138442     -4.201804      1.764748
  C      -3.574425     -5.111255      0.708953
  C      -3.756508     -6.503139      1.319067
  N      -2.919875     -6.560675      2.545950
  C      -3.166183     -7.768436      3.372080
  C      -4.468860     -7.594115      4.149781
  N      -4.839915     -6.182094      4.119828
  Mo     -3.502637     -4.723004      3.709405
  N      -1.619038     -5.272796      4.309245
  C      -0.699093     -5.997050      3.433901
  C      -1.470087     -6.472564      2.209613
  H      -0.264982     -6.840634      3.995093
  H       0.138489     -5.355015      3.116312
  H      -1.118481     -7.457462      1.865227
  H      -1.348394     -5.767456      1.384037
  H      -5.284919     -8.189570      3.710341
  H      -4.335359     -7.936055      5.189891
  H      -3.191351     -8.659400      2.716401
  H      -2.310767     -7.879112      4.058214
  H      -2.831024     -5.142653     -0.100388
  H      -4.522634     -4.753634      0.279573
  H      -3.452175     -7.299146      0.619832
  H      -4.801463     -6.673600      1.600596
  C      -2.454698     -3.076860      1.436540
  C      -2.089923     -2.687212      0.124180
  C      -1.502771     -1.454574     -0.084872
  C      -1.305682     -0.551427      0.982391
  C      -1.639915     -0.913965      2.270585
  C      -2.141700     -2.207121      2.529324
  N      -2.549827     -2.655027      3.766579
  C      -2.204038     -2.059699      4.898559
  C      -0.993038     -1.322542      5.245294
  O      -0.909403     -0.535373      6.150496
  Cl      0.514228     -1.849051      4.363915
  C      -6.105730     -5.861749      4.524474
  C      -7.031185     -6.754100      5.109106
  C      -8.300416     -6.303139      5.437659
  C      -8.680667     -4.974648      5.174826
  C      -7.781397     -4.081047      4.610968
  C      -6.477094     -4.507616      4.303429
  N      -5.487747     -3.727140      3.713211
  C      -5.680970     -2.393550      3.710629
  C      -5.200408     -1.534035      2.665056
  O      -4.898590     -1.821902      1.531058
  Cl     -5.156263      0.197503      3.220796
  C      -1.191026     -4.950761      5.556402
  C       0.137835     -5.063447      6.026468
  C       0.443055     -4.641202      7.304648
  C      -0.549404     -4.081504      8.142476
  C      -1.856726     -3.989159      7.716408
  C      -2.206468     -4.462616      6.433746
  N      -3.476537     -4.450965      5.897479
  C      -4.575096     -4.338799      6.669804
  C      -4.743293     -4.960487      7.958697
  O      -4.016591     -5.709694      8.566006
  Cl     -6.402122     -4.550760      8.622157
  H      -2.310673     -3.328741     -0.726334
  H      -1.241338     -1.152565     -1.099571
  H      -0.919275      0.448093      0.784448
  H      -1.555189     -0.191730      3.080347
  H      -2.882878     -2.152980      5.741982
  H      -6.747828     -7.782807      5.325416
  H      -9.009893     -6.989105      5.901140
  H      -9.692544     -4.643378      5.407831
  H      -8.100939     -3.066777      4.376263
  H      -6.334368     -1.937479      4.457352
  H       0.922813     -5.436791      5.370914
  H       1.471168     -4.701859      7.657700
  H      -0.276629     -3.703614      9.126981
  H      -2.612780     -3.532244      8.352166
  H      -5.470447     -3.917885      6.232291
  N      -7.107570     -5.694046      1.446233
  N      -8.233621     -5.362067      1.488386
  H      -8.967122     -5.883257      0.931684
74
Coordinates from ORCA-job orca E -7353.003889489912
  N      -3.136943     -4.207467      1.764096
  C      -3.571474     -5.117757      0.699327
  C      -3.756045     -6.507693      1.310751
  N      -2.930676     -6.562596      2.545236
  C      -3.200132     -7.770118      3.365487
  C      -4.496279     -7.606518      4.117456
  N      -4.848355     -6.187381      4.119468
  Mo     -3.509887     -4.734164      3.710571
  N      -1.624877     -5.281186      4.311731
  C      -0.707729     -6.009771      3.439194
  C      -1.477646     -6.487409      2.215614
  H      -0.277742     -6.851565      4.003024
  H       0.131050     -5.371048      3.121860
  H      -1.133585     -7.476603      1.875496
  H      -1.349199     -5.786723      1.386838
  H      -5.305243     -8.174704      3.645430
  H      -4.388392     -7.983750      5.138704
  H      -3.228675     -8.633271      2.723930
  H      -2.377878     -7.891870      4.042528
  H      -2.823459     -5.150514     -0.105816
  H      -4.517710     -4.754495      0.264817
  H      -3.433219     -7.304032      0.622510
  H      -4.799124     -6.696379      1.585088
  C      -2.449799     -3.079880      1.443003
  C      -2.078527     -2.684725      0.132247
  C      -1.487139     -1.452107     -0.071450
  C      -1.291090     -0.553081      0.999734
  C      -1.631041     -0.920767      2.286522
  C      -2.138280     -2.213625      2.539191
  N      -2.547649     -2.667126      3.776879
  C      -2.197774     -2.079500      4.912136
  C      -0.987822     -1.331405      5.253840
  O      -0.899819     -0.560087      6.175291
  Cl      0.517043     -1.834793      4.344203
  C      -6.117430     -5.866848      4.521235
  C      -7.048205     -6.763746      5.096862
  C      -8.316753     -6.312330      5.430277
  C      -8.690333     -4.976280      5.181520
  C      -7.786797     -4.079440      4.623806
  C      -6.484304     -4.509230      4.307888
  N      -5.494507     -3.726732      3.716861
  C      -5.681958     -2.388956      3.716476
  C      -5.201791     -1.527373      2.659541
  O      -4.907335     -1.824347      1.520215
  Cl     -5.148734      0.218847      3.201142
  C      -1.185398     -4.941484      5.556740
  C       0.154993     -5.034071      6.023872
  C       0.472990     -4.582994      7.295134
  C      -0.519905     -4.018810      8.128863
  C      -1.839971     -3.950675      7.708104
  C      -2.199457     -4.447854      6.432211
  N      -3.483253     -4.458852      5.899123
  C      -4.586316     -4.359407      6.678234
  C      -4.728059     -4.974802      7.982233
  O      -3.967587     -5.706393      8.602543
  Cl     -6.414586     -4.593801      8.646608
  H      -2.295861     -3.320469     -0.723346
  H      -1.221172     -1.148742     -1.085798
  H      -0.900979      0.446258      0.807078
  H      -1.546319     -0.201606      3.099560
  H      -2.870680     -2.193795      5.766998
  H      -6.769364     -7.796952      5.304335
  H      -9.029055     -7.002545      5.888274
  H      -9.700669     -4.640986      5.419654
  H      -8.104362     -3.059920      4.400390
  H      -6.327415     -1.930880      4.471840
  H       0.938859     -5.407857      5.367623
  H       1.511606     -4.622653      7.645079
  H      -0.238426     -3.617522      9.106399
  H      -2.595876     -3.489473      8.341049
  H      -5.507970     -3.960356      6.237433
  N      -7.096528     -5.682692      1.415001
  N      -8.213717     -5.358735      1.492175
  H      -8.963102     -5.904949      0.933253
74
Coordinates from ORCA-job orca E -7353.006193706730
  N      -3.135776     -4.210705      1.767049
  C      -3.570620     -5.123711      0.708335
  C      -3.748295     -6.515740      1.321197
  N      -2.917504     -6.565591      2.550466
  C      -3.174696     -7.768246      3.379051
  C      -4.499521     -7.609094      4.106291
  N      -4.846276     -6.188770      4.113458
  Mo     -3.502536     -4.734181      3.711449
  N      -1.617170     -5.276430      4.311282
  C      -0.695269     -5.997929      3.436666
  C      -1.465793     -6.484033      2.216193
  H      -0.255051     -6.836200      3.999516
  H       0.137361     -5.351762      3.115603
  H      -1.117146     -7.473281      1.881007
  H      -1.341910     -5.787342      1.383614
  H      -5.308189     -8.171515      3.607369
  H      -4.415612     -8.000268      5.135612
  H      -3.166190     -8.657576      2.738512
  H      -2.350130     -7.857950      4.087317
  H      -2.827870     -5.153918     -0.100450
  H      -4.519720     -4.767889      0.279073
  H      -3.433460     -7.312071      0.628286
  H      -4.789365     -6.695111      1.599215
  C      -2.454770     -3.082548      1.441507
  C      -2.089871     -2.690019      0.129495
  C      -1.506922     -1.454851     -0.078181
  C      -1.313268     -0.551546      0.990197
  C      -1.646285     -0.917118      2.278113
  C      -2.144528     -2.212446      2.535390
  N      -2.548649     -2.663920      3.773637
  C      -2.198582     -2.073678      4.905333
  C      -0.991394     -1.325790      5.242864
  O      -0.905533     -0.551724      6.155202
  Cl      0.508624     -1.826842      4.339977
  C      -6.112887     -5.864320      4.516859
  C      -7.045275     -6.759988      5.087557
  C      -8.312010     -6.305567      5.422539
  C      -8.682562     -4.968485      5.179702
  C      -7.777645     -4.072922      4.625939
  C      -6.476668     -4.505249      4.309262
  N      -5.485833     -3.726487      3.718627
  C      -5.674828     -2.393166      3.718974
  C      -5.193506     -1.534378      2.669726
  O      -4.891449     -1.824657      1.535200
  Cl     -5.156251      0.198453      3.215066
  C      -1.185591     -4.945349      5.557227
  C       0.148288     -5.042082      6.025038
  C       0.456420     -4.605890      7.300235
  C      -0.539292     -4.051475      8.137402
  C      -1.852447     -3.977303      7.714609
  C      -2.202838     -4.460850      6.434449
  N      -3.476176     -4.462016      5.899576
  C      -4.571472     -4.348648      6.673758
  C      -4.735392     -4.962868      7.966000
  O      -4.025485     -5.718015      8.568657
  Cl     -6.370999     -4.529766      8.641231
  H      -2.307296     -3.330367     -0.722829
  H      -1.245974     -1.151525     -1.092986
  H      -0.930579      0.449899      0.793504
  H      -1.564441     -0.194624      3.088638
  H      -2.869924     -2.184652      5.758359
  H      -6.768517     -7.794509      5.288443
  H      -9.026414     -6.994305      5.876375
  H      -9.692153     -4.632288      5.418384
  H      -8.092453     -3.052885      4.404645
  H      -6.327360     -1.936237      4.467080
  H       0.935094     -5.409869      5.368602
  H       1.489293     -4.651093      7.651109
  H      -0.264919     -3.662637      9.118997
  H      -2.611421     -3.523930      8.350040
  H      -5.466910     -3.929753      6.237030
  N      -7.102389     -5.683981      1.435877
  N      -8.217558     -5.340929      1.502510
  H      -8.981115     -5.869058      0.960365
74
Coordinates from ORCA-job orca E -7353.004226782639
  N      -3.149730     -4.208062      1.768808
  C      -3.585276     -5.119338      0.718097
  C      -3.750560     -6.515179      1.323794
  N      -2.916457     -6.563412      2.555317
  C      -3.151657     -7.758421      3.399814
  C      -4.489688     -7.590614      4.124466
  N      -4.849312     -6.177333      4.125528
  Mo     -3.503266     -4.718581      3.716408
  N      -1.616889     -5.258261      4.313282
  C      -0.695338     -5.976695      3.434759
  C      -1.468828     -6.468135      2.217581
  H      -0.245439     -6.813302      3.996837
  H       0.131622     -5.325349      3.104935
  H      -1.109852     -7.454688      1.885452
  H      -1.352436     -5.771354      1.383561
  H      -5.290374     -8.159746      3.638730
  H      -4.400972     -7.964722      5.153610
  H      -3.122155     -8.686274      2.762075
  H      -2.306186     -7.815821      4.137080
  H      -2.847487     -5.143908     -0.097695
  H      -4.540551     -4.770701      0.297561
  H      -3.433174     -7.306219      0.622009
  H      -4.801338     -6.700618      1.603109
  C      -2.462148     -3.088637      1.429147
  C      -2.101349     -2.708491      0.113204
  C      -1.505011     -1.482311     -0.104874
  C      -1.295501     -0.576101      0.956919
  C      -1.628463     -0.927679      2.247992
  C      -2.139125     -2.215351      2.516420
  N      -2.550454     -2.650576      3.755059
  C      -2.213795     -2.046302      4.887136
  C      -1.006521     -1.308248      5.245401
  O      -0.936667     -0.504667      6.142948
  Cl      0.516449     -1.846189      4.393608
  C      -6.115129     -5.856271      4.524524
  C      -7.049136     -6.750610      5.090089
  C      -8.318289     -6.295660      5.412310
  C      -8.691359     -4.964531      5.158245
  C      -7.784886     -4.069669      4.608506
  C      -6.480022     -4.500072      4.310750
  N      -5.484120     -3.721420      3.729477
  C      -5.670688     -2.385797      3.738107
  C      -5.195087     -1.523747      2.699299
  O      -4.897905     -1.800225      1.565965
  Cl     -5.144361      0.200078      3.272838
  C      -1.185990     -4.932301      5.556208
  C       0.140829     -5.047596      6.020440
  C       0.444147     -4.635191      7.299150
  C      -0.546608     -4.077955      8.141259
  C      -1.850177     -3.978337      7.717610
  C      -2.199620     -4.446700      6.435216
  N      -3.472360     -4.443932      5.903602
  C      -4.573975     -4.363390      6.685152
  C      -4.714858     -5.005660      7.971375
  O      -3.929503     -5.721502      8.579962
  Cl     -6.422052     -4.696641      8.628060
  H      -2.332025     -3.354845     -0.730748
  H      -1.244403     -1.185848     -1.121210
  H      -0.900401      0.418233      0.751196
  H      -1.535525     -0.202583      3.053614
  H      -2.903173     -2.118741      5.715956
  H      -6.773191     -7.784096      5.293228
  H      -9.035698     -6.982092      5.861851
  H      -9.704045     -4.633770      5.385999
  H      -8.093882     -3.052318      4.375144
  H      -6.320430     -1.934582      4.489721
  H       0.923549     -5.422946      5.362711
  H       1.468352     -4.703737      7.649233
  H      -0.275124     -3.710223      9.127209
  H      -2.608094     -3.526751      8.355144
  H      -5.489440     -3.958754      6.256913
  N      -7.098891     -5.696587      1.441469
  N      -8.217223     -5.316147      1.471767
  H      -8.962126     -5.839369      0.956004
74
Coordinates from ORCA-job orca E -7353.006759522217
  N      -3.143352     -4.213742      1.769995
  C      -3.581849     -5.127030      0.716926
  C      -3.749982     -6.521452      1.327593
  N      -2.915931     -6.568223      2.555971
  C      -3.166347     -7.763073      3.396648
  C      -4.509308     -7.608409      4.094053
  N      -4.850735     -6.187082      4.115500
  Mo     -3.503087     -4.730807      3.715407
  N      -1.616619     -5.269558      4.311625
  C      -0.693573     -5.985955      3.434002
  C      -1.466539     -6.480901      2.218016
  H      -0.243017     -6.819867      3.996318
  H       0.131763     -5.333053      3.106319
  H      -1.113286     -7.469900      1.887481
  H      -1.348947     -5.787500      1.381740
  H      -5.309006     -8.157565      3.566739
  H      -4.451611     -8.017567      5.118262
  H      -3.129708     -8.668457      2.770356
  H      -2.351558     -7.825096      4.128205
  H      -2.845593     -5.153295     -0.098948
  H      -4.536610     -4.776221      0.295592
  H      -3.432579     -7.313930      0.630369
  H      -4.793567     -6.704549      1.603610
  C      -2.457624     -3.090432      1.437582
  C      -2.094437     -2.704517      0.123376
  C      -1.504215     -1.474049     -0.089957
  C      -1.302370     -0.568604      0.974866
  C      -1.635623     -0.926929      2.264571
  C      -2.140661     -2.218443      2.527613
  N      -2.548946     -2.661669      3.766385
  C      -2.206523     -2.063718      4.898138
  C      -1.000860     -1.316451      5.245578
  O      -0.925059     -0.528773      6.152650
  Cl      0.511018     -1.829464      4.365132
  C      -6.117560     -5.863364      4.515302
  C      -7.054069     -6.761245      5.075059
  C      -8.322199     -6.307837      5.404163
  C      -8.691330     -4.971286      5.163709
  C      -7.783096     -4.073704      4.618984
  C      -6.479701     -4.504085      4.310775
  N      -5.485253     -3.723625      3.728174
  C      -5.669083     -2.387998      3.738590
  C      -5.186373     -1.522887      2.696890
  O      -4.889911     -1.803447      1.558612
  Cl     -5.131972      0.206798      3.264859
  C      -1.183512     -4.937429      5.555894
  C       0.150078     -5.034701      6.020394
  C       0.458828     -4.600890      7.295173
  C      -0.534822     -4.045637      8.134170
  C      -1.846960     -3.968950      7.713615
  C      -2.199184     -4.453031      6.434788
  N      -3.473599     -4.456994      5.902897
  C      -4.571196     -4.359670      6.680485
  C      -4.725051     -4.986037      7.969766
  O      -3.983127     -5.724274      8.575552
  Cl     -6.391834     -4.604220      8.637274
  H      -2.318712     -3.347531     -0.725015
  H      -1.243296     -1.174982     -1.105841
  H      -0.913397      0.429334      0.773384
  H      -1.548399     -0.202616      3.072409
  H      -2.887514     -2.159470      5.740326
  H      -6.779871     -7.796995      5.270379
  H      -9.040188     -6.997939      5.849874
  H      -9.702602     -4.637906      5.397019
  H      -8.094405     -3.053792      4.397004
  H      -6.317674     -1.934222      4.491380
  H       0.935645     -5.403346      5.362874
  H       1.490993     -4.648335      7.643736
  H      -0.259391     -3.658462      9.115290
  H      -2.604980     -3.514861      8.349021
  H      -5.475294     -3.948873      6.246608
  N      -7.092221     -5.685289      1.444819
  N      -8.203175     -5.314772      1.499327
  H      -8.969097     -5.842715      0.985991
74
Coordinates from ORCA-job orca E -7353.006888466287
  N      -3.144524     -4.219215      1.769931
  C      -3.578656     -5.137074      0.715789
  C      -3.743737     -6.530552      1.329739
  N      -2.911719     -6.569288      2.560380
  C      -3.160584     -7.757426      3.410230
  C      -4.521521     -7.612290      4.061515
  N      -4.852294     -6.189384      4.111755
  Mo     -3.501392     -4.735034      3.716152
  N      -1.613181     -5.264905      4.313476
  C      -0.688027     -5.975912      3.433769
  C      -1.461987     -6.482655      2.222322
  H      -0.226838     -6.803956      3.996108
  H       0.129358     -5.315933      3.100149
  H      -1.107872     -7.474601      1.900847
  H      -1.345033     -5.796860      1.379347
  H      -5.303116     -8.135408      3.496032
  H      -4.500669     -8.050617      5.066737
  H      -3.085932     -8.675378      2.804149
  H      -2.366701     -7.784920      4.168655
  H      -2.840557     -5.163569     -0.097660
  H      -4.533051     -4.789089      0.292038
  H      -3.421937     -7.324861      0.637061
  H      -4.786505     -6.718538      1.609521
  C      -2.460638     -3.094551      1.435906
  C      -2.098619     -2.709018      0.121034
  C      -1.509844     -1.478041     -0.093499
  C      -1.308320     -0.571830      0.970716
  C      -1.640421     -0.929474      2.261030
  C      -2.143941     -2.221237      2.525521
  N      -2.549032     -2.664885      3.765438
  C      -2.203679     -2.069768      4.897542
  C      -0.999057     -1.321356      5.240668
  O      -0.920026     -0.544098      6.152191
  Cl      0.508491     -1.822742      4.348795
  C      -6.119021     -5.864173      4.512799
  C      -7.059114     -6.764310      5.062577
  C      -8.326003     -6.309064      5.395532
  C      -8.689728     -4.967914      5.168287
  C      -7.778676     -4.068828      4.630410
  C      -6.477323     -4.502250      4.317215
  N      -5.483193     -3.722383      3.733682
  C      -5.666358     -2.387887      3.744496
  C      -5.187880     -1.526316      2.698323
  O      -4.892473     -1.810807      1.561808
  Cl     -5.137112      0.203417      3.256037
  C      -1.180921     -4.932182      5.558229
  C       0.152863     -5.026055      6.023279
  C       0.459235     -4.594356      7.299305
  C      -0.537152     -4.044392      8.138882
  C      -1.849100     -3.970031      7.717057
  C      -2.198376     -4.451744      6.436815
  N      -3.473229     -4.458997      5.904409
  C      -4.569862     -4.363760      6.683038
  C      -4.717505     -4.984791      7.976321
  O      -3.975297     -5.719136      8.583172
  Cl     -6.379687     -4.604101      8.646130
  H      -2.321917     -3.352714     -0.727154
  H      -1.249363     -1.179526     -1.109908
  H      -0.920123      0.426119      0.768315
  H      -1.553000     -0.204442      3.068228
  H      -2.881324     -2.173945      5.745751
  H      -6.788600     -7.803579      5.246212
  H      -9.046871     -7.000644      5.834259
  H      -9.699590     -4.632007      5.405479
  H      -8.086635     -3.044990      4.417519
  H      -6.315723     -1.934059      4.497099
  H       0.939806     -5.391614      5.365569
  H       1.490899     -4.640470      7.648761
  H      -0.264397     -3.660161      9.121590
  H      -2.610338     -3.521528      8.353608
  H      -5.477907     -3.957342      6.249426
  N      -7.100719     -5.672274      1.441314
  N      -8.203613     -5.282017      1.505642
  H      -8.993955     -5.813846      1.008525
74
Coordinates from ORCA-job orca E -7353.007002179833
  N      -3.143191     -4.224396      1.773900
  C      -3.576223     -5.142968      0.721788
  C      -3.741111     -6.537189      1.335775
  N      -2.908644     -6.573792      2.565698
  C      -3.159572     -7.754420      3.423916
  C      -4.543458     -7.622529      4.027610
  N      -4.856661     -6.194279      4.107948
  Mo     -3.502008     -4.739393      3.719667
  N      -1.612037     -5.266087      4.312905
  C      -0.685515     -5.974819      3.433212
  C      -1.459727     -6.489280      2.225861
  H      -0.218701     -6.798389      3.996122
  H       0.127032     -5.311624      3.096216
  H      -1.106283     -7.482737      1.909294
  H      -1.345172     -5.808340      1.379351
  H      -5.312374     -8.118019      3.409084
  H      -4.568546     -8.100074      5.021704
  H      -3.047959     -8.677732      2.837986
  H      -2.392639     -7.752592      4.204635
  H      -2.838491     -5.168270     -0.092437
  H      -4.531655     -4.797614      0.298648
  H      -3.419037     -7.330085      0.641773
  H      -4.784375     -6.722466      1.608593
  C      -2.459939     -3.100057      1.440161
  C      -2.097681     -2.715392      0.125369
  C      -1.510155     -1.483978     -0.089448
  C      -1.309834     -0.576617      0.974345
  C      -1.641995     -0.933948      2.264571
  C      -2.144454     -2.226124      2.529007
  N      -2.549765     -2.670204      3.768481
  C      -2.207661     -2.070961      4.899520
  C      -1.006767     -1.314097      5.244263
  O      -0.935455     -0.529905      6.154313
  Cl      0.508352     -1.814152      4.361285
  C      -6.122761     -5.865953      4.508687
  C      -7.065403     -6.765828      5.052795
  C      -8.330502     -6.308797      5.389588
  C      -8.690776     -4.965848      5.170123
  C      -7.778472     -4.067674      4.635222
  C      -6.478402     -4.502690      4.318127
  N      -5.483671     -3.724515      3.735137
  C      -5.666195     -2.390317      3.744538
  C      -5.189534     -1.531666      2.696786
  O      -4.893777     -1.818372      1.561346
  Cl     -5.142848      0.197889      3.249129
  C      -1.177826     -4.929725      5.555921
  C       0.157144     -5.018974      6.017201
  C       0.466339     -4.581863      7.290750
  C      -0.527972     -4.030386      8.130919
  C      -1.841433     -3.961362      7.713405
  C      -2.193962     -4.450014      6.436552
  N      -3.470464     -4.464673      5.907587
  C      -4.566239     -4.373198      6.686807
  C      -4.710403     -4.990913      7.982092
  O      -3.964014     -5.720310      8.591552
  Cl     -6.374099     -4.613910      8.651331
  H      -2.320419     -3.359445     -0.722778
  H      -1.249916     -1.186158     -1.105837
  H      -0.922869      0.421841      0.771751
  H      -1.555843     -0.208112      3.071208
  H      -2.886698     -2.173807      5.744485
  H      -6.797447     -7.806143      5.230792
  H      -9.052313     -6.999770      5.825806
  H      -9.698916     -4.627530      5.411260
  H      -8.084982     -3.042558      4.428418
  H      -6.313050     -1.933833      4.497136
  H       0.942919     -5.383603      5.357948
  H       1.498913     -4.623998      7.637385
  H      -0.252482     -3.640485      9.110830
  H      -2.600011     -3.510311      8.350345
  H      -5.476821     -3.975679      6.250543
  N      -7.090756     -5.662368      1.441321
  N      -8.185423     -5.249890      1.505668
  H      -8.987759     -5.780090      1.048430
74
Coordinates from ORCA-job orca E -7353.006816076685
  N      -3.149529     -4.228221      1.775113
  C      -3.584166     -5.146620      0.726014
  C      -3.732633     -6.539642      1.339803
  N      -2.899846     -6.583400      2.566764
  C      -3.166010     -7.765245      3.420856
  C      -4.534624     -7.619906      4.059334
  N      -4.864531     -6.197982      4.119090
  Mo     -3.499888     -4.738583      3.723548
  N      -1.613642     -5.262519      4.317198
  C      -0.683510     -5.971243      3.440940
  C      -1.451719     -6.490865      2.232879
  H      -0.214978     -6.792453      4.006886
  H       0.126679     -5.304580      3.103207
  H      -1.090255     -7.482689      1.920944
  H      -1.337508     -5.810163      1.385463
  H      -5.312024     -8.137485      3.464523
  H      -4.533402     -8.076200      5.069436
  H      -3.089890     -8.683081      2.818706
  H      -2.389441     -7.788371      4.191856
  H      -2.854902     -5.164519     -0.098121
  H      -4.549730     -4.808120      0.309936
  H      -3.407215     -7.325900      0.637727
  H      -4.776671     -6.724366      1.614114
  C      -2.471510     -3.102708      1.432630
  C      -2.121270     -2.720308      0.114088
  C      -1.532748     -1.490543     -0.107878
  C      -1.317786     -0.582281      0.952941
  C      -1.639540     -0.936278      2.245976
  C      -2.146756     -2.226512      2.516530
  N      -2.548993     -2.663903      3.757338
  C      -2.199529     -2.068633      4.887510
  C      -0.994651     -1.318650      5.228089
  O      -0.916473     -0.532589      6.136244
  Cl      0.509538     -1.822558      4.338562
  C      -6.135129     -5.874224      4.503867
  C      -7.092578     -6.773916      5.024572
  C      -8.358323     -6.309921      5.348235
  C      -8.707622     -4.960608      5.139503
  C      -7.782735     -4.063974      4.624293
  C      -6.482306     -4.508691      4.318582
  N      -5.478727     -3.730939      3.749831
  C      -5.645637     -2.390276      3.791606
  C      -5.154773     -1.504637      2.768581
  O      -4.870138     -1.757786      1.619664
  Cl     -5.069507      0.216802      3.385829
  C      -1.177632     -4.924624      5.560205
  C       0.159738     -5.005992      6.019854
  C       0.468976     -4.560690      7.291829
  C      -0.528769     -4.012810      8.130863
  C      -1.846115     -3.953711      7.714423
  C      -2.196557     -4.446864      6.438324
  N      -3.472427     -4.462199      5.905200
  C      -4.571085     -4.371683      6.684871
  C      -4.719095     -5.011731      7.967874
  O      -3.976532     -5.754352      8.561079
  Cl     -6.372743     -4.637393      8.651204
  H      -2.354976     -3.367023     -0.728938
  H      -1.280898     -1.192675     -1.126034
  H      -0.928278      0.414638      0.744293
  H      -1.544717     -0.210069      3.051572
  H      -2.876544     -2.162922      5.729291
  H      -6.837219     -7.819762      5.192493
  H      -9.092328     -7.000865      5.765266
  H      -9.717507     -4.619995      5.370962
  H      -8.074499     -3.033740      4.418061
  H      -6.283208     -1.947098      4.560025
  H       0.948611     -5.367429      5.361483
  H       1.505407     -4.593046      7.636257
  H      -0.252186     -3.616447      9.108905
  H      -2.610209     -3.504518      8.346595
  H      -5.471115     -3.951894      6.255388
  N      -7.072159     -5.676729      1.437337
  N      -8.169352     -5.272127      1.495967
  H      -8.950801     -5.814531      1.043972
74
Coordinates from ORCA-job orca E -7353.007196847438
  N      -3.147864     -4.228599      1.775037
  C      -3.580978     -5.149555      0.725094
  C      -3.734899     -6.542323      1.341969
  N      -2.903055     -6.578662      2.570606
  C      -3.161451     -7.757597      3.431183
  C      -4.539080     -7.617940      4.044306
  N      -4.862518     -6.194433      4.116094
  Mo     -3.500360     -4.738687      3.723695
  N      -1.610720     -5.257754      4.314274
  C      -0.682398     -5.966386      3.436163
  C      -1.454943     -6.490558      2.232218
  H      -0.210569     -6.785451      4.002359
  H       0.126053     -5.299544      3.094380
  H      -1.097524     -7.485229      1.923781
  H      -1.341587     -5.814872      1.380468
  H      -5.306070     -8.123051      3.434895
  H      -4.553954     -8.085156      5.041857
  H      -3.059968     -8.683798      2.843539
  H      -2.394204     -7.757631      4.214733
  H      -2.848348     -5.171348     -0.093791
  H      -4.541415     -4.809634      0.305920
  H      -3.408794     -7.332408      0.645858
  H      -4.777224     -6.727273      1.618302
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  C      -2.111795     -2.722941      0.116108
  C      -1.522690     -1.493566     -0.105430
  C      -1.312949     -0.583802      0.954917
  C      -1.639600     -0.936275      2.247558
  C      -2.144862     -2.226779      2.518555
  N      -2.548922     -2.663346      3.760123
  C      -2.204191     -2.066521      4.891060
  C      -1.002358     -1.314038      5.235957
  O      -0.930040     -0.529398      6.144310
  Cl      0.507636     -1.814557      4.352481
  C      -6.131819     -5.868554      4.505355
  C      -7.086095     -6.769070      5.028626
  C      -8.353093     -6.309640      5.352629
  C      -8.705689     -4.963992      5.141420
  C      -7.782713     -4.064922      4.626377
  C      -6.480889     -4.503700      4.321056
  N      -5.478116     -3.724516      3.751187
  C      -5.649881     -2.386977      3.782700
  C      -5.166303     -1.512747      2.749329
  O      -4.879706     -1.779238      1.605182
  Cl     -5.092942      0.210483      3.341011
  C      -1.174485     -4.921254      5.557280
  C       0.161288     -5.005844      6.016673
  C       0.468709     -4.568610      7.290793
  C      -0.528131     -4.022652      8.131693
  C      -1.842630     -3.957505      7.714766
  C      -2.192453     -4.445729      6.437495
  N      -3.468045     -4.462480      5.906419
  C      -4.564019     -4.375614      6.688953
  C      -4.705767     -5.011654      7.974728
  O      -3.954143     -5.744434      8.572135
  Cl     -6.370305     -4.653321      8.652740
  H      -2.341459     -3.369324     -0.728246
  H      -1.267331     -1.197717     -1.123723
  H      -0.923816      0.412860      0.746634
  H      -1.548653     -0.208252      3.051911
  H      -2.882810     -2.166975      5.734859
  H      -6.827404     -7.813014      5.196612
  H      -9.085493     -7.002195      5.769834
  H      -9.716400     -4.626456      5.371429
  H      -8.080096     -3.038312      4.419982
  H      -6.290717     -1.938673      4.545348
  H       0.948902     -5.367049      5.357285
  H       1.502208     -4.606850      7.636417
  H      -0.253295     -3.633155      9.111921
  H      -2.605184     -3.510575      8.350282
  H      -5.471474     -3.967950      6.259667
  N      -7.092991     -5.668376      1.433597
  N      -8.186928     -5.252344      1.501448
  H      -8.992107     -5.793982      1.054868
74
Coordinates from ORCA-job orca E -7353.007211944729
  N      -3.147206     -4.227624      1.774580
  C      -3.579882     -5.148867      0.724447
  C      -3.735072     -6.541313      1.342082
  N      -2.902946     -6.577854      2.570636
  C      -3.160752     -7.756759      3.431503
  C      -4.540225     -7.618652      4.042546
  N      -4.863347     -6.194880      4.114817
  Mo     -3.501242     -4.737949      3.723838
  N      -1.611770     -5.257944      4.313990
  C      -0.682888     -5.966886      3.436425
  C      -1.455307     -6.490623      2.232390
  H      -0.211958     -6.785918      4.002834
  H       0.125872     -5.300274      3.095830
  H      -1.098745     -7.485330      1.923322
  H      -1.342289     -5.814917      1.380863
  H      -5.305703     -8.123366      3.431939
  H      -4.556608     -8.086476      5.039557
  H      -3.058064     -8.682780      2.844740
  H      -2.393945     -7.754977      4.214418
  H      -2.846569     -5.170586     -0.093920
  H      -4.540005     -4.808579      0.305014
  H      -3.409098     -7.331238      0.646005
  H      -4.777895     -6.725339      1.617650
  C      -2.466357     -3.102753      1.434767
  C      -2.112273     -2.719892      0.116878
  C      -1.521747     -1.491076     -0.103565
  C      -1.308971     -0.583458      0.957684
  C      -1.635132     -0.937215      2.250133
  C      -2.142552     -2.226850      2.519637
  N      -2.545745     -2.664903      3.761005
  C      -2.200792     -2.069349      4.892938
  C      -0.999398     -1.313481      5.237909
  O      -0.927001     -0.535478      6.152176
  Cl      0.513427     -1.805628      4.348738
  C      -6.132141     -5.868827      4.504862
  C      -7.087315     -6.770276      5.025074
  C      -8.353153     -6.309295      5.352394
  C      -8.702927     -4.959754      5.149512
  C      -7.779360     -4.060437      4.636246
  C      -6.479557     -4.501772      4.325747
  N      -5.478548     -3.723904      3.753863
  C      -5.653034     -2.387644      3.778367
  C      -5.178190     -1.522818      2.736246
  O      -4.889011     -1.799292      1.596958
  Cl     -5.125972      0.201280      3.303129
  C      -1.175124     -4.921135      5.557221
  C       0.160694     -5.005997      6.017269
  C       0.468180     -4.568381      7.291588
  C      -0.528566     -4.021960      8.132134
  C      -1.843037     -3.956529      7.714794
  C      -2.192686     -4.444809      6.437352
  N      -3.468800     -4.462768      5.906472
  C      -4.564247     -4.376457      6.690500
  C      -4.702635     -5.012460      7.977288
  O      -3.950447     -5.746186      8.573795
  Cl     -6.366006     -4.654043      8.657091
  H      -2.343474     -3.364046     -0.728598
  H      -1.267335     -1.194565     -1.121860
  H      -0.917748      0.412371      0.750582
  H      -1.541097     -0.211102      3.055277
  H      -2.879303     -2.176350      5.739607
  H      -6.830611     -7.816587      5.188094
  H      -9.085952     -7.002509      5.767384
  H      -9.711837     -4.619280      5.384446
  H      -8.074943     -3.029668      4.437331
  H      -6.295189     -1.935960      4.538051
  H       0.948287     -5.367336      5.358155
  H       1.501607     -4.606870      7.637897
  H      -0.253886     -3.632591      9.112616
  H      -2.605374     -3.509521      8.350713
  H      -5.474095     -3.969639      6.261595
  N      -7.092131     -5.665789      1.427714
  N      -8.185028     -5.248865      1.494912
  H      -8.988670     -5.792577      1.055801
74
Coordinates from ORCA-job orca E -7353.007246906266
  N      -3.150085     -4.231717      1.774349
  C      -3.583396     -5.155170      0.726028
  C      -3.734316     -6.548252      1.345176
  N      -2.902794     -6.579101      2.574788
  C      -3.157702     -7.753132      3.442951
  C      -4.548022     -7.620830      4.029411
  N      -4.866933     -6.196458      4.113508
  Mo     -3.504490     -4.739108      3.725036
  N      -1.611893     -5.253269      4.312747
  C      -0.681729     -5.960006      3.434679
  C      -1.455692     -6.491833      2.234643
  H      -0.204644     -6.774844      4.002315
  H       0.122507     -5.289827      3.089823
  H      -1.098796     -7.488056      1.930652
  H      -1.345213     -5.821074      1.378677
  H      -5.303242     -8.113836      3.398034
  H      -4.584151     -8.102673      5.018324
  H      -3.035189     -8.685745      2.869101
  H      -2.402314     -7.731471      4.238105
  H      -2.852304     -5.175673     -0.094469
  H      -4.545488     -4.817404      0.309620
  H      -3.403140     -7.337483      0.650489
  H      -4.777999     -6.736732      1.618295
  C      -2.467461     -3.108628      1.432462
  C      -2.113494     -2.728376      0.113485
  C      -1.520911     -1.500899     -0.109541
  C      -1.305784     -0.591757      0.950073
  C      -1.632116     -0.942773      2.243393
  C      -2.141519     -2.231162      2.515573
  N      -2.545812     -2.665746      3.758037
  C      -2.202206     -2.067593      4.888932
  C      -1.001431     -1.311613      5.234616
  O      -0.930176     -0.530554      6.146273
  Cl      0.511624     -1.805529      4.348286
  C      -6.136163     -5.870425      4.501182
  C      -7.094070     -6.773549      5.013145
  C      -8.360230     -6.312959      5.339787
  C      -8.707331     -4.961868      5.144585
  C      -7.781041     -4.060665      4.639055
  C      -6.481388     -4.501882      4.328205
  N      -5.478425     -3.722226      3.760891
  C      -5.647410     -2.384115      3.796469
  C      -5.166988     -1.510972      2.761661
  O      -4.882391     -1.779590      1.617926
  Cl     -5.093657      0.211412      3.348039
  C      -1.174431     -4.914234      5.555449
  C       0.162631     -4.993704      6.014546
  C       0.469365     -4.555570      7.288945
  C      -0.529353     -4.014059      8.130645
  C      -1.844808     -3.953542      7.714259
  C      -2.193119     -4.441935      6.436643
  N      -3.469794     -4.463919      5.906737
  C      -4.564828     -4.382372      6.692974
  C      -4.699378     -5.022392      7.978464
  O      -3.944850     -5.755319      8.571794
  Cl     -6.363189     -4.671328      8.661660
  H      -2.346405     -3.373044     -0.731254
  H      -1.266967     -1.206649     -1.128749
  H      -0.912841      0.403104      0.741110
  H      -1.536648     -0.215164      3.047084
  H      -2.881610     -2.169755      5.733399
  H      -6.839494     -7.821148      5.169988
  H      -9.095426     -7.007760      5.747818
  H      -9.716237     -4.621293      5.379156
  H      -8.075083     -3.028434      4.445751
  H      -6.285341     -1.935584      4.561793
  H       0.951461     -5.351281      5.354724
  H       1.503537     -4.590029      7.634669
  H      -0.255475     -3.624479      9.111247
  H      -2.608856     -3.510205      8.351239
  H      -5.476917     -3.978284      6.266195
  N      -7.090199     -5.668419      1.417258
  N      -8.178401     -5.237205      1.488764
  H      -8.992787     -5.784406      1.074299
74
Coordinates from ORCA-job orca E -7353.007239836934
  N      -3.146721     -4.230679      1.774727
  C      -3.577132     -5.155638      0.727055
  C      -3.733096     -6.544942      1.351019
  N      -2.899607     -6.578924      2.577771
  C      -3.157252     -7.754709      3.443914
  C      -4.540911     -7.619677      4.046204
  N      -4.865380     -6.196648      4.118659
  Mo     -3.501972     -4.737533      3.726314
  N      -1.610338     -5.249730      4.312017
  C      -0.679938     -5.959905      3.436551
  C      -1.452768     -6.492881      2.237276
  H      -0.205137     -6.773986      4.006689
  H       0.125688     -5.291680      3.091761
  H      -1.096434     -7.489683      1.934599
  H      -1.341980     -5.823299      1.380744
  H      -5.301069     -8.124484      3.425456
  H      -4.563862     -8.091603      5.042897
  H      -3.048663     -8.683022      2.864120
  H      -2.395788     -7.742737      4.230038
  H      -2.843425     -5.179237     -0.090554
  H      -4.536772     -4.817951      0.305837
  H      -3.410465     -7.336255      0.655471
  H      -4.775348     -6.719409      1.630593
  C      -2.466554     -3.107192      1.431481
  C      -2.114249     -2.728499      0.111664
  C      -1.525023     -1.500101     -0.113250
  C      -1.311492     -0.588320      0.945316
  C      -1.636351     -0.937966      2.239268
  C      -2.142410     -2.227276      2.512954
  N      -2.545841     -2.659711      3.755827
  C      -2.201432     -2.060398      4.885217
  C      -1.000200     -1.306090      5.231272
  O      -0.929842     -0.518099      6.138583
  Cl      0.511453     -1.809352      4.352285
  C      -6.135561     -5.871263      4.501592
  C      -7.093861     -6.771742      5.013028
  C      -8.361837     -6.312567      5.332500
  C      -8.711488     -4.966709      5.129722
  C      -7.784493     -4.067549      4.626472
  C      -6.482111     -4.505883      4.324151
  N      -5.475773     -3.725383      3.763734
  C      -5.643657     -2.387929      3.804807
  C      -5.159334     -1.510379      2.775607
  O      -4.875599     -1.773182      1.629780
  Cl     -5.072910      0.209121      3.375653
  C      -1.173284     -4.913827      5.555264
  C       0.161369     -4.998288      6.014506
  C       0.466621     -4.564284      7.290026
  C      -0.530103     -4.019903      8.131035
  C      -1.843270     -3.953295      7.713741
  C      -2.191210     -4.440836      6.436220
  N      -3.466108     -4.462223      5.904681
  C      -4.560903     -4.380414      6.690071
  C      -4.696453     -5.024373      7.971698
  O      -3.938349     -5.755273      8.565758
  Cl     -6.362895     -4.678216      8.651491
  H      -2.346100     -3.374949     -0.732541
  H      -1.272753     -1.206851     -1.133068
  H      -0.921395      0.407342      0.734754
  H      -1.543146     -0.208262      3.042228
  H      -2.879570     -2.157099      5.726714
  H      -6.837806     -7.815420      5.175475
  H      -9.097641     -7.004983      5.739271
  H      -9.722238     -4.628272      5.357774
  H      -8.080205     -3.039968      4.427860
  H      -6.280077     -1.941275      4.571940
  H       0.949509     -5.357500      5.355190
  H       1.498366     -4.604130      7.636884
  H      -0.256466     -3.633130      9.112283
  H      -2.605373     -3.507586      8.350196
  H      -5.471636     -3.975090      6.262692
  N      -7.115313     -5.662941      1.406006
  N      -8.204281     -5.234201      1.481148
  H      -9.023205     -5.787243      1.075308
74
Coordinates from ORCA-job orca E -7353.007314027158
  N      -3.149175     -4.230662      1.774121
  C      -3.582379     -5.155914      0.727430
  C      -3.734942     -6.546464      1.350895
  N      -2.901000     -6.578263      2.577749
  C      -3.156641     -7.753176      3.445170
  C      -4.541062     -7.618306      4.045719
  N      -4.866350     -6.195333      4.117035
  Mo     -3.503429     -4.736377      3.726241
  N      -1.611365     -5.249651      4.312707
  C      -0.680684     -5.958084      3.436051
  C      -1.454209     -6.491109      2.236740
  H      -0.204563     -6.772165      4.005383
  H       0.124025     -5.288568      3.091205
  H      -1.097193     -7.487474      1.933441
  H      -1.344103     -5.821108      1.380258
  H      -5.300303     -8.123364      3.426510
  H      -4.564475     -8.088658      5.041907
  H      -3.046331     -8.683074      2.866074
  H      -2.394196     -7.739557      4.232427
  H      -2.851237     -5.178464     -0.092754
  H      -4.543988     -4.818483      0.309568
  H      -3.409446     -7.337422      0.656055
  H      -4.777355     -6.726919      1.629741
  C      -2.467765     -3.107880      1.430389
  C      -2.116929     -2.728697      0.110363
  C      -1.525745     -1.501100     -0.114834
  C      -1.308530     -0.590782      0.943675
  C      -1.631936     -0.940724      2.237901
  C      -2.140339     -2.229037      2.511950
  N      -2.542777     -2.661809      3.755272
  C      -2.197133     -2.064074      4.885308
  C      -0.994367     -1.311683      5.230915
  O      -0.921237     -0.529435      6.141791
  Cl      0.516534     -1.809486      4.344437
  C      -6.136793     -5.870315      4.500365
  C      -7.097132     -6.773505      5.007086
  C      -8.365396     -6.314416      5.326611
  C      -8.712405     -4.964925      5.130406
  C      -7.783246     -4.063143      4.631954
  C      -6.481685     -4.502668      4.327463
  N      -5.476023     -3.721661      3.767117
  C      -5.643389     -2.383861      3.807635
  C      -5.161606     -1.508059      2.775846
  O      -4.877126     -1.773592      1.631383
  Cl     -5.085683      0.211772      3.367478
  C      -1.174194     -4.912412      5.555838
  C       0.161766     -4.993721      6.015329
  C       0.467470     -4.558064      7.290640
  C      -0.530884     -4.016640      8.132315
  C      -1.845412     -3.953867      7.715174
  C      -2.192804     -4.440648      6.436963
  N      -3.468162     -4.461514      5.905752
  C      -4.562866     -4.381296      6.692378
  C      -4.697945     -5.028734      7.972960
  O      -3.941471     -5.763362      8.562927
  Cl     -6.363963     -4.683673      8.656257
  H      -2.351519     -3.373858     -0.733717
  H      -1.274796     -1.207628     -1.134894
  H      -0.916592      0.404183      0.733108
  H      -1.535466     -0.212110      3.040931
  H      -2.875727     -2.164653      5.729828
  H      -6.843247     -7.820374      5.164117
  H      -9.103402     -7.009973      5.728167
  H      -9.723097     -4.626091      5.358483
  H      -8.077033     -3.032758      4.437532
  H      -6.281427     -1.937407      4.573938
  H       0.950892     -5.350871      5.355770
  H       1.500764     -4.594248      7.637011
  H      -0.257474     -3.628818      9.113619
  H      -2.608933     -3.510333      8.352068
  H      -5.473072     -3.973336      6.268058
  N      -7.102656     -5.666191      1.408841
  N      -8.191109     -5.237063      1.483978
  H      -9.007375     -5.790431      1.077870
74
Coordinates from ORCA-job orca E -7353.007339264143
  N      -3.149959     -4.230611      1.772998
  C      -3.583551     -5.157014      0.727361
  C      -3.735579     -6.547255      1.351790
  N      -2.900686     -6.577774      2.578261
  C      -3.154696     -7.751605      3.447203
  C      -4.540341     -7.618478      4.045062
  N      -4.866782     -6.195628      4.115583
  Mo     -3.504574     -4.735572      3.725870
  N      -1.611943     -5.247913      4.312612
  C      -0.680488     -5.955507      3.435860
  C      -1.453943     -6.489922      2.236943
  H      -0.203173     -6.768679      4.005405
  H       0.123183     -5.285017      3.090721
  H      -1.096258     -7.486125      1.933963
  H      -1.344519     -5.820278      1.380156
  H      -5.297625     -8.124333      3.425088
  H      -4.565238     -8.088249      5.040918
  H      -3.041982     -8.682575      2.869570
  H      -2.392301     -7.735091      4.234893
  H      -2.852988     -5.179894     -0.093454
  H      -4.545687     -4.820274      0.309960
  H      -3.410977     -7.338852      0.657500
  H      -4.778026     -6.727803      1.632340
  C      -2.468255     -3.108242      1.428844
  C      -2.117958     -2.729099      0.108608
  C      -1.525667     -1.502020     -0.116809
  C      -1.306565     -0.592357      0.941698
  C      -1.629530     -0.942198      2.236166
  C      -2.139475     -2.229732      2.510298
  N      -2.541563     -2.662212      3.753893
  C      -2.194474     -2.064865      4.883798
  C      -0.990281     -1.314114      5.228263
  O      -0.914243     -0.535017      6.141323
  Cl      0.518887     -1.811219      4.337270
  C      -6.137382     -5.870976      4.498716
  C      -7.097914     -6.774791      5.003554
  C      -8.365918     -6.315275      5.324526
  C      -8.712150     -4.964568      5.132173
  C      -7.782910     -4.062602      4.634994
  C      -6.481914     -4.502635      4.328625
  N      -5.476667     -3.721179      3.769473
  C      -5.643680     -2.383512      3.811047
  C      -5.162954     -1.507776      2.778585
  O      -4.878601     -1.774268      1.634376
  Cl     -5.088859      0.212019      3.367924
  C      -1.175299     -4.910215      5.555967
  C       0.160815     -4.990309      6.016296
  C       0.465734     -4.555419      7.292191
  C      -0.533719     -4.015990      8.134039
  C      -1.848280     -3.954116      7.716027
  C      -2.194562     -4.439709      6.436971
  N      -3.470053     -4.461163      5.905322
  C      -4.565100     -4.382938      6.692063
  C      -4.699086     -5.032259      7.972039
  O      -3.943683     -5.769192      8.560014
  Cl     -6.363417     -4.686460      8.657335
  H      -2.353508     -3.373730     -0.735574
  H      -1.275166     -1.208857     -1.137141
  H      -0.913356      0.402034      0.731187
  H      -1.531117     -0.214231      3.039379
  H      -2.872459     -2.165357      5.729466
  H      -6.844219     -7.822121      5.158830
  H      -9.103681     -7.010896      5.725179
  H      -9.722217     -4.624672      5.362332
  H      -8.076023     -3.030535      4.444583
  H      -6.282004     -1.937755      4.577631
  H       0.950777     -5.346080      5.356969
  H       1.499060     -4.590899      7.639153
  H      -0.261317     -3.629153      9.116082
  H      -2.612744     -3.512450      8.353347
  H      -5.476401     -3.974708      6.268317
  N      -7.100450     -5.665177      1.403229
  N      -8.187078     -5.232069      1.480784
  H      -9.006086     -5.788057      1.085459
74
Coordinates from ORCA-job orca E -7353.007386852717
  N      -3.152644     -4.231418      1.771952
  C      -3.588188     -5.161312      0.730205
  C      -3.738222     -6.550088      1.358768
  N      -2.899700     -6.576481      2.582811
  C      -3.149780     -7.747497      3.456020
  C      -4.536950     -7.617409      4.050623
  N      -4.867758     -6.195027      4.114483
  Mo     -3.506444     -4.732882      3.727088
  N      -1.612121     -5.242292      4.313205
  C      -0.679323     -5.947647      3.435666
  C      -1.453427     -6.486911      2.239023
  H      -0.197914     -6.757885      4.005903
  H       0.121124     -5.274553      3.088238
  H      -1.094154     -7.483066      1.937865
  H      -1.346380     -5.819198      1.380458
  H      -5.291061     -8.129097      3.432026
  H      -4.562326     -8.082458      5.048422
  H      -3.033797     -8.680204      2.881269
  H      -2.386572     -7.725969      4.243296
  H      -2.859680     -5.185967     -0.092422
  H      -4.551832     -4.826914      0.314547
  H      -3.417798     -7.344450      0.665991
  H      -4.779172     -6.728770      1.645993
  C      -2.470434     -3.110778      1.425059
  C      -2.123254     -2.733313      0.103595
  C      -1.529775     -1.507179     -0.124468
  C      -1.306061     -0.597160      0.932636
  C      -1.625736     -0.945446      2.228382
  C      -2.137347     -2.231677      2.505009
  N      -2.537010     -2.662092      3.750006
  C      -2.185922     -2.064999      4.878791
  C      -0.977327     -1.320033      5.220794
  O      -0.894399     -0.545245      6.136552
  Cl      0.527160     -1.817934      4.320660
  C      -6.140219     -5.871710      4.493166
  C      -7.104390     -6.778596      4.987093
  C      -8.374180     -6.320355      5.303646
  C      -8.717431     -4.966932      5.120549
  C      -7.784164     -4.061879      4.635118
  C      -6.482822     -4.501670      4.330215
  N      -5.475717     -3.717791      3.779278
  C      -5.640251     -2.380314      3.827747
  C      -5.158326     -1.501143      2.798366
  O      -4.874051     -1.765550      1.653835
  Cl     -5.083500      0.216006      3.391229
  C      -1.176327     -4.903608      5.556504
  C       0.160083     -4.980335      6.017451
  C       0.463658     -4.547428      7.294428
  C      -0.537748     -4.013177      8.137464
  C      -1.852402     -3.953886      7.718603
  C      -2.196808     -4.436875      6.438014
  N      -3.472109     -4.459442      5.905794
  C      -4.566826     -4.386954      6.693625
  C      -4.698468     -5.044721      7.969428
  O      -3.942675     -5.786073      8.551403
  Cl     -6.361820     -4.703292      8.659255
  H      -2.362030     -3.377918     -0.739704
  H      -1.282292     -1.215568     -1.145972
  H      -0.911741      0.396464      0.720455
  H      -1.523439     -0.217206      3.030850
  H      -2.862685     -2.163401      5.726569
  H      -6.852514     -7.827976      5.136055
  H      -9.115514     -7.019067      5.693743
  H      -9.728212     -4.627127      5.347738
  H      -8.075092     -3.027283      4.452413
  H      -6.280332     -1.938178      4.594943
  H       0.951600     -5.332273      5.357936
  H       1.497143     -4.580501      7.641750
  H      -0.266970     -3.628242      9.120834
  H      -2.618260     -3.516420      8.357161
  H      -5.478946     -3.976699      6.273558
  N      -7.099850     -5.664195      1.389121
  N      -8.180901     -5.218926      1.473407
  H      -9.010094     -5.779977      1.109908
74
Coordinates from ORCA-job orca E -7353.007433167759
  N      -3.155076     -4.231422      1.770708
  C      -3.591628     -5.164660      0.732463
  C      -3.739718     -6.551593      1.364726
  N      -2.897758     -6.575000      2.586553
  C      -3.144838     -7.743856      3.463169
  C      -4.532223     -7.616154      4.057820
  N      -4.868124     -6.194475      4.113441
  Mo     -3.507743     -4.730125      3.727886
  N      -1.611932     -5.236721      4.313991
  C      -0.677925     -5.939798      3.435841
  C      -1.451983     -6.483197      2.240887
  H      -0.192955     -6.747503      4.006543
  H       0.119703     -5.264503      3.086420
  H      -1.090741     -7.479012      1.941083
  H      -1.347160     -5.816638      1.381195
  H      -5.284281     -8.135515      3.443122
  H      -4.555814     -8.074533      5.058895
  H      -3.027444     -8.677326      2.889651
  H      -2.380012     -7.719831      4.249068
  H      -2.864587     -5.191099     -0.091645
  H      -4.556921     -4.833270      0.317651
  H      -3.424836     -7.348891      0.673133
  H      -4.779230     -6.727341      1.659652
  C      -2.473237     -3.111755      1.421381
  C      -2.128380     -2.735548      0.098960
  C      -1.533911     -1.510156     -0.131083
  C      -1.306597     -0.600016      0.925044
  C      -1.623716     -0.947165      2.221814
  C      -2.136898     -2.232335      2.500241
  N      -2.534309     -2.661247      3.746374
  C      -2.177395     -2.065186      4.874072
  C      -0.963038     -1.327913      5.212151
  O      -0.870595     -0.558797      6.131817
  Cl      0.534263     -1.828530      4.300324
  C      -6.141945     -5.872364      4.488987
  C      -7.106795     -6.779840      4.978745
  C      -8.377725     -6.322425      5.292482
  C      -8.721332     -4.969673      5.111118
  C      -7.787052     -4.064014      4.630748
  C      -6.484520     -4.502470      4.329034
  N      -5.475828     -3.716660      3.785028
  C      -5.639409     -2.379399      3.838756
  C      -5.156487     -1.496401      2.812485
  O      -4.872273     -1.757911      1.667133
  Cl     -5.081259      0.218672      3.410417
  C      -1.177558     -4.898031      5.557548
  C       0.159023     -4.972175      6.019272
  C       0.460929     -4.542398      7.297674
  C      -0.542741     -4.014012      8.142011
  C      -1.857435     -3.956578      7.722059
  C      -2.199566     -4.435410      6.439420
  N      -3.474368     -4.457656      5.905769
  C      -4.569872     -4.390596      6.693089
  C      -4.701895     -5.056527      7.964616
  O      -3.947703     -5.804018      8.540636
  Cl     -6.364470     -4.717003      8.657829
  H      -2.369373     -3.380509     -0.743418
  H      -1.288377     -1.219690     -1.153435
  H      -0.911299      0.392917      0.711591
  H      -1.518217     -0.219082      3.023983
  H      -2.851593     -2.161366      5.724852
  H      -6.854104     -7.828419      5.127494
  H      -9.119520     -7.021303      5.679160
  H      -9.732838     -4.630371      5.336022
  H      -8.077882     -3.029564      4.450679
  H      -6.281363     -1.940695      4.606305
  H       0.952164     -5.319989      5.359415
  H       1.494555     -4.573524      7.645520
  H      -0.273826     -3.632063      9.127066
  H      -2.625017     -3.523719      8.361874
  H      -5.481887     -3.977859      6.275197
  N      -7.098508     -5.662985      1.370772
  N      -8.172092     -5.201481      1.463048
  H      -9.014348     -5.765867      1.137098
74
Coordinates from ORCA-job orca E -7353.007493953230
  N      -3.159079     -4.232879      1.771193
  C      -3.596169     -5.170025      0.737049
  C      -3.740845     -6.554488      1.373819
  N      -2.894763     -6.573705      2.592670
  C      -3.138725     -7.740332      3.472779
  C      -4.526254     -7.615135      4.067091
  N      -4.867892     -6.194182      4.113007
  Mo     -3.507915     -4.728045      3.730655
  N      -1.610199     -5.230665      4.316326
  C      -0.675435     -5.930281      3.436661
  C      -1.449779     -6.479075      2.244302
  H      -0.185222     -6.734752      4.007219
  H       0.118238     -5.252275      3.083834
  H      -1.086105     -7.474630      1.946694
  H      -1.347867     -5.814352      1.382937
  H      -5.276275     -8.143825      3.456893
  H      -4.547768     -8.065706      5.072083
  H      -3.018236     -8.674231      2.901292
  H      -2.373743     -7.713335      4.257816
  H      -2.870298     -5.198399     -0.087902
  H      -4.563271     -4.843161      0.323125
  H      -3.433145     -7.355819      0.684035
  H      -4.777023     -6.726669      1.678895
  C      -2.478648     -3.113942      1.418391
  C      -2.137121     -2.739513      0.094764
  C      -1.543097     -1.514414     -0.138079
  C      -1.312938     -0.603110      0.916499
  C      -1.626057     -0.948810      2.214543
  C      -2.138788     -2.233658      2.495687
  N      -2.532280     -2.660651      3.743294
  C      -2.167280     -2.064815      4.868717
  C      -0.945105     -1.338842      5.200960
  O      -0.839692     -0.573643      6.122952
  Cl      0.541030     -1.846057      4.275427
  C      -6.144456     -5.874093      4.482262
  C      -7.112092     -6.783989      4.962824
  C      -8.385136     -6.328144      5.270134
  C      -8.727366     -4.974021      5.093653
  C      -7.789979     -4.065927      4.623453
  C      -6.486073     -4.503660      4.326583
  N      -5.474857     -3.715576      3.791212
  C      -5.638339     -2.378896      3.851194
  C      -5.152416     -1.490272      2.830895
  O      -4.866693     -1.746093      1.684543
  Cl     -5.075823      0.221301      3.439112
  C      -1.177352     -4.891684      5.559804
  C       0.158987     -4.963085      6.021528
  C       0.459151     -4.537039      7.301384
  C      -0.545957     -4.014333      8.147256
  C      -1.860045     -3.958149      7.726695
  C      -2.200597     -4.433440      6.442393
  N      -3.474844     -4.456263      5.907386
  C      -4.570752     -4.394843      6.693524
  C      -4.702680     -5.066757      7.961703
  O      -3.948723     -5.818150      8.534110
  Cl     -6.363712     -4.727953      8.657178
  H      -2.380220     -3.385958     -0.745911
  H      -1.300212     -1.225128     -1.161347
  H      -0.918439      0.389680      0.700902
  H      -1.518416     -0.220065      3.016068
  H      -2.837439     -2.153750      5.721343
  H      -6.859670     -7.833379      5.108473
  H      -9.129639     -7.029049      5.648628
  H      -9.740184     -4.635545      5.313888
  H      -8.079373     -3.030075      4.447629
  H      -6.283922     -1.944582      4.617970
  H       0.952936     -5.307099      5.360899
  H       1.492049     -4.566935      7.649509
  H      -0.278605     -3.635738      9.133974
  H      -2.628631     -3.529764      8.367787
  H      -5.483485     -3.982021      6.275857
  N      -7.098538     -5.663387      1.345139
  N      -8.158115     -5.173314      1.448658
  H      -9.023443     -5.732969      1.177500
74
Coordinates from ORCA-job orca E -7353.007570939621
  N      -3.163619     -4.234260      1.773033
  C      -3.601619     -5.173371      0.741918
  C      -3.740801     -6.557179      1.380272
  N      -2.892095     -6.573070      2.597795
  C      -3.134344     -7.738728      3.479777
  C      -4.520809     -7.613659      4.077521
  N      -4.867242     -6.193341      4.113462
  Mo     -3.507440     -4.726763      3.733958
  N      -1.608153     -5.227415      4.319642
  C      -0.673263     -5.923160      3.438069
  C      -1.448053     -6.475571      2.247488
  H      -0.178241     -6.725680      4.007400
  H       0.117142     -5.242658      3.082343
  H      -1.082348     -7.470774      1.951171
  H      -1.348805     -5.811788      1.385023
  H      -5.271161     -8.151548      3.474638
  H      -4.537853     -8.055257      5.087329
  H      -3.012584     -8.672272      2.908722
  H      -2.368817     -7.711619      4.264012
  H      -2.877927     -5.201231     -0.084974
  H      -4.571414     -4.851498      0.330802
  H      -3.437100     -7.360814      0.691344
  H      -4.774522     -6.729783      1.692942
  C      -2.486013     -3.114729      1.417332
  C      -2.147865     -2.740936      0.092782
  C      -1.555558     -1.515372     -0.142041
  C      -1.324143     -0.602880      0.911530
  C      -1.633267     -0.948145      2.210460
  C      -2.143960     -2.233757      2.493548
  N      -2.531785     -2.660903      3.742458
  C      -2.155980     -2.067243      4.866050
  C      -0.924225     -1.353681      5.190409
  O      -0.802284     -0.597567      6.118216
  Cl      0.549094     -1.863777      4.244253
  C      -6.145579     -5.874898      4.478066
  C      -7.113064     -6.785219      4.957161
  C      -8.388187     -6.331621      5.257754
  C      -8.733176     -4.980152      5.075068
  C      -7.795512     -4.071074      4.608143
  C      -6.488456     -4.505760      4.320412
  N      -5.474915     -3.715832      3.791225
  C      -5.640317     -2.379132      3.854577
  C      -5.151868     -1.484614      2.840754
  O      -4.864256     -1.733012      1.693086
  Cl     -5.074663      0.223966      3.461622
  C      -1.176663     -4.888770      5.563097
  C       0.159879     -4.957574      6.024141
  C       0.459047     -4.534045      7.304880
  C      -0.547342     -4.016786      8.152439
  C      -1.861421     -3.962445      7.732290
  C      -2.200927     -4.434106      6.446557
  N      -3.474308     -4.455316      5.910000
  C      -4.571488     -4.396330      6.693410
  C      -4.707680     -5.071124      7.959563
  O      -3.956342     -5.827072      8.530324
  Cl     -6.368958     -4.729437      8.653750
  H      -2.392400     -3.389195     -0.746102
  H      -1.314930     -1.226070     -1.165767
  H      -0.931687      0.390441      0.694104
  H      -1.524776     -0.219101      3.011845
  H      -2.820670     -2.154082      5.724106
  H      -6.858402     -7.832735      5.106856
  H      -9.132710     -7.032787      5.635121
  H      -9.748160     -4.644454      5.288643
  H      -8.086330     -3.037698      4.427494
  H      -6.288810     -1.948137      4.620473
  H       0.954209     -5.297775      5.362041
  H       1.492002     -4.561499      7.652519
  H      -0.280680     -3.640547      9.140215
  H      -2.630867     -3.537588      8.374369
  H      -5.482178     -3.982503      6.273889
  N      -7.089501     -5.669784      1.313993
  N      -8.130045     -5.141942      1.428595
  H      -9.021661     -5.687331      1.222027
74
Coordinates from ORCA-job orca E -7353.007653876251
  N      -3.169680     -4.235783      1.776113
  C      -3.607195     -5.175231      0.745134
  C      -3.738474     -6.560120      1.383110
  N      -2.889510     -6.572599      2.600810
  C      -3.131695     -7.739157      3.482021
  C      -4.517197     -7.612386      4.083280
  N      -4.866466     -6.192611      4.113732
  Mo     -3.505882     -4.727254      3.737593
  N      -1.606309     -5.227662      4.323866
  C      -0.671225     -5.918089      3.439657
  C      -1.446273     -6.472115      2.249829
  H      -0.171643     -6.720027      4.005940
  H       0.116001     -5.234382      3.082729
  H      -1.078752     -7.466813      1.954014
  H      -1.349272     -5.808528      1.386806
  H      -5.269010     -8.155394      3.486223
  H      -4.529993     -8.048074      5.096089
  H      -3.008655     -8.672157      2.911153
  H      -2.367358     -7.712829      4.266977
  H      -2.885066     -5.199634     -0.083142
  H      -4.579815     -4.857392      0.336865
  H      -3.432467     -7.363524      0.694866
  H      -4.769941     -6.739390      1.698357
  C      -2.494817     -3.114475      1.418701
  C      -2.159656     -2.739385      0.093706
  C      -1.568298     -1.513619     -0.141369
  C      -1.334958     -0.601808      0.912370
  C      -1.640995     -0.948131      2.211512
  C      -2.150492     -2.234383      2.494690
  N      -2.534012     -2.662109      3.744241
  C      -2.148361     -2.069609      4.866055
  C      -0.907526     -1.371453      5.183918
  O      -0.768557     -0.622248      6.115818
  Cl      0.550832     -1.888143      4.219635
  C      -6.145351     -5.875141      4.477075
  C      -7.111753     -6.785292      4.958795
  C      -8.387725     -6.332788      5.256248
  C      -8.735565     -4.983123      5.066007
  C      -7.799048     -4.073932      4.597157
  C      -6.489685     -4.506912      4.315851
  N      -5.476005     -3.716823      3.786159
  C      -5.646000     -2.380246      3.845778
  C      -5.158149     -1.485158      2.833172
  O      -4.867276     -1.730603      1.685742
  Cl     -5.089691      0.223337      3.455539
  C      -1.175140     -4.889535      5.567444
  C       0.162418     -4.954657      6.026921
  C       0.461217     -4.531891      7.307981
  C      -0.546646     -4.020507      8.157337
  C      -1.861586     -3.969571      7.738699
  C      -2.200328     -4.438115      6.451873
  N      -3.472946     -4.456876      5.913757
  C      -4.572386     -4.398048      6.694003
  C      -4.714015     -5.071004      7.960822
  O      -3.965079     -5.828328      8.533005
  Cl     -6.376509     -4.725533      8.651624
  H      -2.406058     -3.388043     -0.744104
  H      -1.329117     -1.222623     -1.164942
  H      -0.943720      0.391710      0.694159
  H      -1.531634     -0.220272      3.013787
  H      -2.807959     -2.148453      5.725907
  H      -6.855449     -7.831622      5.112802
  H      -9.131137     -7.033652      5.636612
  H      -9.751945     -4.649406      5.276029
  H      -8.091195     -3.042314      4.409867
  H      -6.297090     -1.949002      4.609488
  H       0.956841     -5.290726      5.362690
  H       1.494970     -4.555407      7.654497
  H      -0.280049     -3.645546      9.145596
  H      -2.632273     -3.547969      8.381625
  H      -5.481147     -3.985370      6.270588
  N      -7.073833     -5.677253      1.282012
  N      -8.090628     -5.109363      1.408842
  H      -9.009459     -5.630995      1.263678
74
Coordinates from ORCA-job orca E -7353.007715984060
  N      -3.171950     -4.238341      1.779304
  C      -3.608214     -5.176012      0.746508
  C      -3.734249     -6.563119      1.381828
  N      -2.887448     -6.574646      2.601633
  C      -3.130827     -7.742924      3.480536
  C      -4.515491     -7.613563      4.084770
  N      -4.864291     -6.193976      4.115117
  Mo     -3.503289     -4.730237      3.740234
  N      -1.605215     -5.233213      4.327907
  C      -0.669610     -5.920883      3.442649
  C      -1.444469     -6.473734      2.251910
  H      -0.168474     -6.723739      4.006407
  H       0.116471     -5.235018      3.087019
  H      -1.077049     -7.468413      1.955755
  H      -1.347596     -5.809930      1.389026
  H      -5.269572     -8.156007      3.490062
  H      -4.525255     -8.048160      5.098141
  H      -3.008243     -8.675781      2.909805
  H      -2.367584     -7.717040      4.266501
  H      -2.887422     -5.195534     -0.082920
  H      -4.582326     -4.859192      0.340704
  H      -3.420897     -7.363216      0.692712
  H      -4.766374     -6.750466      1.692904
  C      -2.502932     -3.113249      1.421767
  C      -2.172574     -2.734797      0.096538
  C      -1.586942     -1.506331     -0.137794
  C      -1.354725     -0.594581      0.916915
  C      -1.656232     -0.943985      2.215938
  C      -2.159982     -2.233116      2.498003
  N      -2.536172     -2.665126      3.747945
  C      -2.141831     -2.075632      4.869057
  C      -0.894671     -1.385343      5.180534
  O      -0.742023     -0.647676      6.119333
  Cl      0.554016     -1.897535      4.196369
  C      -6.143006     -5.877439      4.477287
  C      -7.108264     -6.787793      4.962406
  C      -8.384814     -6.336382      5.258058
  C      -8.734900     -4.987271      5.061534
  C      -7.799935     -4.078079      4.588636
  C      -6.489195     -4.510069      4.310366
  N      -5.476742     -3.720437      3.776743
  C      -5.650589     -2.383330      3.832855
  C      -5.164588     -1.487470      2.820955
  O      -4.873321     -1.729695      1.672701
  Cl     -5.096017      0.222276      3.447665
  C      -1.174336     -4.896078      5.572044
  C       0.162362     -4.963022      6.031504
  C       0.460927     -4.538660      7.311983
  C      -0.545272     -4.023244      8.160015
  C      -1.859176     -3.970145      7.741609
  C      -2.198684     -4.441486      6.455861
  N      -3.470530     -4.458601      5.916479
  C      -4.571542     -4.390866      6.692682
  C      -4.718835     -5.049998      7.966029
  O      -3.973127     -5.803046      8.548620
  Cl     -6.381927     -4.692957      8.646406
  H      -2.419174     -3.383565     -0.741299
  H      -1.351135     -1.211988     -1.161069
  H      -0.968201      0.400962      0.698673
  H      -1.547934     -0.217277      3.019610
  H      -2.796644     -2.158215      5.734689
  H      -6.851098     -7.833711      5.120191
  H      -9.126845     -7.037308      5.642221
  H      -9.751908     -4.654651      5.270584
  H      -8.093213     -3.046904      4.395860
  H      -6.299617     -1.950938      4.597792
  H       0.955308     -5.301544      5.367233
  H       1.493377     -4.564012      7.658829
  H      -0.277856     -3.646888      9.147470
  H      -2.628465     -3.544677      8.382952
  H      -5.477913     -3.980901      6.260637
  N      -7.054734     -5.684781      1.253120
  N      -8.050523     -5.083001      1.391368
  H      -8.989318     -5.579865      1.297010
74
Coordinates from ORCA-job orca E -7353.007756843533
  N      -3.174855     -4.240557      1.781770
  C      -3.611641     -5.177620      0.748478
  C      -3.733558     -6.565355      1.381942
  N      -2.888186     -6.575759      2.602671
  C      -3.130748     -7.744492      3.481508
  C      -4.516482     -7.615587      4.084350
  N      -4.865593     -6.196380      4.116059
  Mo     -3.504066     -4.733331      3.742411
  N      -1.606356     -5.235985      4.328824
  C      -0.669527     -5.920591      3.441937
  C      -1.445308     -6.474970      2.252172
  H      -0.164959     -6.722484      4.004144
  H       0.113630     -5.231228      3.086312
  H      -1.078244     -7.470028      1.956738
  H      -1.349363     -5.812552      1.388000
  H      -5.269736     -8.156679      3.488091
  H      -4.526309     -8.051346      5.096668
  H      -3.006695     -8.678835      2.912973
  H      -2.368721     -7.714634      4.268677
  H      -2.893081     -5.193700     -0.082797
  H      -4.587365     -4.862127      0.346030
  H      -3.412323     -7.361736      0.691881
  H      -4.765244     -6.757643      1.686988
  C      -2.506138     -3.114875      1.424304
  C      -2.177718     -2.734706      0.098725
  C      -1.591043     -1.506881     -0.135008
  C      -1.355253     -0.596999      0.920520
  C      -1.655761     -0.947373      2.219531
  C      -2.161223     -2.235847      2.500747
  N      -2.537006     -2.667688      3.750815
  C      -2.141247     -2.079130      4.872234
  C      -0.891908     -1.394564      5.184828
  O      -0.734632     -0.661607      6.126707
  Cl      0.553593     -1.905655      4.194540
  C      -6.144654     -5.879478      4.477562
  C      -7.111352     -6.788857      4.961892
  C      -8.387998     -6.336248      5.255943
  C      -8.737002     -4.986861      5.057879
  C      -7.800721     -4.078600      4.585420
  C      -6.489911     -4.511745      4.309270
  N      -5.477271     -3.722885      3.775384
  C      -5.651941     -2.385759      3.830359
  C      -5.168070     -1.491526      2.816908
  O      -4.875742     -1.734524      1.669629
  Cl     -5.105679      0.218785      3.438590
  C      -1.173358     -4.896299      5.572272
  C       0.165443     -4.956426      6.029451
  C       0.465298     -4.526612      7.308290
  C      -0.542185     -4.014572      8.157308
  C      -1.858480     -3.969264      7.741673
  C      -2.198046     -4.443446      6.456935
  N      -3.470434     -4.463554      5.918367
  C      -4.571925     -4.394881      6.695207
  C      -4.717417     -5.049799      7.970909
  O      -3.969548     -5.797796      8.556294
  Cl     -6.382535     -4.696789      8.649042
  H      -2.426808     -3.381230     -0.739992
  H      -1.356846     -1.211205     -1.158417
  H      -0.967249      0.397817      0.702520
  H      -1.544964     -0.222386      3.024186
  H      -2.796148     -2.159695      5.737474
  H      -6.856077     -7.835171      5.120134
  H      -9.131095     -7.036592      5.639301
  H      -9.754035     -4.653521      5.265656
  H      -8.092816     -3.047331      4.391033
  H      -6.299976     -1.952951      4.596082
  H       0.958981     -5.291764      5.363948
  H       1.499991     -4.544770      7.653060
  H      -0.273915     -3.634267      9.143339
  H      -2.628863     -3.545662      8.383658
  H      -5.479366     -3.988125      6.262241
  N      -7.049275     -5.692461      1.230144
  N      -8.025994     -5.062553      1.377331
  H      -8.979795     -5.535618      1.321371
74
Coordinates from ORCA-job orca E -7353.007782186430
  N      -3.173671     -4.239681      1.780968
  C      -3.611085     -5.175576      0.746270
  C      -3.732993     -6.565566      1.379744
  N      -2.888255     -6.575614      2.601148
  C      -3.129837     -7.744887      3.479362
  C      -4.515264     -7.615721      4.083236
  N      -4.862887     -6.196536      4.117883
  Mo     -3.502973     -4.733292      3.741466
  N      -1.608536     -5.239890      4.330627
  C      -0.669513     -5.922549      3.443085
  C      -1.444787     -6.475434      2.251641
  H      -0.164516     -6.725050      4.004107
  H       0.112397     -5.229957      3.090954
  H      -1.078320     -7.470394      1.955198
  H      -1.347908     -5.812417      1.387881
  H      -5.269475     -8.152126      3.485302
  H      -4.524959     -8.055348      5.093866
  H      -3.010607     -8.679768      2.910056
  H      -2.365139     -7.715719      4.264372
  H      -2.894189     -5.189648     -0.086584
  H      -4.586346     -4.855533      0.344870
  H      -3.404222     -7.358120      0.688877
  H      -4.767425     -6.763537      1.680651
  C      -2.506646     -3.112867      1.423768
  C      -2.182634     -2.729731      0.097802
  C      -1.597791     -1.500798     -0.135139
  C      -1.358545     -0.593259      0.921629
  C      -1.655328     -0.946376      2.220869
  C      -2.160451     -2.235151      2.500596
  N      -2.534249     -2.668953      3.750714
  C      -2.137491     -2.080491      4.872236
  C      -0.886693     -1.399816      5.185113
  O      -0.724065     -0.672517      6.130164
  Cl      0.555655     -1.909881      4.188545
  C      -6.140432     -5.879968      4.481836
  C      -7.104962     -6.790464      4.968631
  C      -8.382001     -6.339762      5.264776
  C      -8.733283     -4.990746      5.066181
  C      -7.799059     -4.081544      4.590918
  C      -6.487861     -4.512358      4.312116
  N      -5.478414     -3.723046      3.773468
  C      -5.653402     -2.385725      3.824104
  C      -5.176214     -1.497576      2.802205
  O      -4.887232     -1.748923      1.655787
  Cl     -5.119639      0.217096      3.408225
  C      -1.175934     -4.901976      5.574972
  C       0.162230     -4.964847      6.033978
  C       0.461556     -4.534200      7.312388
  C      -0.545673     -4.018197      8.159659
  C      -1.861297     -3.970426      7.742564
  C      -2.200410     -4.446101      6.458389
  N      -3.472251     -4.462965      5.919030
  C      -4.575350     -4.388824      6.694939
  C      -4.724024     -5.038971      7.972828
  O      -3.977433     -5.783323      8.562850
  Cl     -6.392281     -4.685230      8.646024
  H      -2.434083     -3.373338     -0.742514
  H      -1.367888     -1.202895     -1.158966
  H      -0.970990      0.401971      0.704577
  H      -1.541358     -0.223554      3.027002
  H      -2.793005     -2.158258      5.736750
  H      -6.848583     -7.836804      5.127336
  H      -9.123145     -7.041433      5.649572
  H      -9.750256     -4.658369      5.275909
  H      -8.093108     -3.050444      4.396680
  H      -6.297461     -1.950381      4.592128
  H       0.956200     -5.302572      5.370096
  H       1.495744     -4.554783      7.658294
  H      -0.277966     -3.636815      9.145144
  H      -2.630959     -3.543474      8.383482
  H      -5.481443     -3.980767      6.261364
  N      -7.036912     -5.686283      1.221556
  N      -8.008973     -5.052164      1.374181
  H      -8.964544     -5.522927      1.331688
74
Coordinates from ORCA-job orca E -7353.007799088964
  N      -3.174287     -4.242650      1.781010
  C      -3.611908     -5.181760      0.749527
  C      -3.731021     -6.568486      1.383596
  N      -2.885210     -6.577290      2.603924
  C      -3.124174     -7.744872      3.485179
  C      -4.511462     -7.619352      4.086527
  N      -4.862613     -6.200894      4.118894
  Mo     -3.502926     -4.735521      3.742142
  N      -1.608919     -5.239250      4.331804
  C      -0.667428     -5.918894      3.443641
  C      -1.441796     -6.475926      2.253418
  H      -0.158433     -6.718317      4.004994
  H       0.110304     -5.222215      3.091006
  H      -1.073986     -7.470903      1.958871
  H      -1.346051     -5.814667      1.388284
  H      -5.262616     -8.157849      3.486783
  H      -4.522236     -8.058605      5.097260
  H      -3.003723     -8.681061      2.917891
  H      -2.359230     -7.711031      4.269750
  H      -2.896872     -5.195495     -0.085070
  H      -4.589542     -4.866889      0.350245
  H      -3.400435     -7.359760      0.692337
  H      -4.763562     -6.764316      1.682763
  C      -2.510862     -3.114888      1.421940
  C      -2.192077     -2.730876      0.094967
  C      -1.610565     -1.500555     -0.139297
  C      -1.368834     -0.593018      0.917221
  C      -1.660399     -0.946999      2.217410
  C      -2.163211     -2.236493      2.498097
  N      -2.533157     -2.670775      3.749064
  C      -2.133302     -2.083593      4.870106
  C      -0.879567     -1.408122      5.181637
  O      -0.710511     -0.687720      6.130627
  Cl      0.557991     -1.915710      4.175564
  C      -6.142781     -5.884532      4.479608
  C      -7.110741     -6.793912      4.961052
  C      -8.387910     -6.340200      5.254350
  C      -8.735186     -4.988844      5.059689
  C      -7.797514     -4.081049      4.588875
  C      -6.487544     -4.515890      4.311170
  N      -5.477103     -3.727670      3.776349
  C      -5.649980     -2.390299      3.831909
  C      -5.173818     -1.500386      2.810271
  O      -4.886565     -1.751531      1.663167
  Cl     -5.114460      0.214051      3.417536
  C      -1.177096     -4.900417      5.576092
  C       0.160656     -4.960885      6.035623
  C       0.458776     -4.529041      7.313723
  C      -0.549203     -4.013279      8.160248
  C      -1.864404     -3.967594      7.742533
  C      -2.202424     -4.445689      6.458988
  N      -3.474017     -4.465286      5.919141
  C      -4.577317     -4.391643      6.694827
  C      -4.724223     -5.041113      7.973005
  O      -3.975337     -5.781211      8.565454
  Cl     -6.394712     -4.692988      8.643688
  H      -2.445074     -3.373888     -0.745533
  H      -1.385682     -1.202056     -1.164059
  H      -0.983438      0.402951      0.699421
  H      -1.544187     -0.224592      3.023806
  H      -2.787875     -2.161275      5.736382
  H      -6.857471     -7.841439      5.118268
  H      -9.131913     -7.040892      5.634590
  H      -9.751562     -4.653585      5.268589
  H      -8.087791     -3.047610      4.398315
  H      -6.292327     -1.957581      4.602908
  H       0.955609     -5.298081      5.372787
  H       1.492368     -4.548526      7.660006
  H      -0.282697     -3.630533      9.145444
  H      -2.634328     -3.541124      8.383208
  H      -5.484141     -3.984784      6.261410
  N      -7.034215     -5.693596      1.201024
  N      -7.979432     -5.021649      1.361315
  H      -8.951164     -5.461147      1.364131
74
Coordinates from ORCA-job orca E -7353.007817057494
  N      -3.172847     -4.241832      1.780666
  C      -3.611576     -5.179133      0.748613
  C      -3.735100     -6.567924      1.382786
  N      -2.888768     -6.578355      2.602309
  C      -3.127678     -7.746653      3.482092
  C      -4.512343     -7.620179      4.087519
  N      -4.863087     -6.201505      4.118516
  Mo     -3.504068     -4.736248      3.740828
  N      -1.610683     -5.240422      4.330667
  C      -0.670312     -5.921179      3.442114
  C      -1.444918     -6.477604      2.251781
  H      -0.161935     -6.720699      4.003857
  H       0.107906     -5.225329      3.088924
  H      -1.077584     -7.472756      1.957212
  H      -1.348164     -5.816146      1.387028
  H      -5.265254     -8.160606      3.490827
  H      -4.520048     -8.057510      5.098903
  H      -3.011345     -8.681757      2.911408
  H      -2.359770     -7.717016      4.263988
  H      -2.895697     -5.195010     -0.085036
  H      -4.587159     -4.860140      0.348082
  H      -3.407391     -7.359690      0.690571
  H      -4.768679     -6.760413      1.683757
  C      -2.506407     -3.115798      1.422529
  C      -2.184277     -2.732922      0.096151
  C      -1.599965     -1.503854     -0.137291
  C      -1.359238     -0.596557      0.919526
  C      -1.654096     -0.949493      2.219318
  C      -2.159352     -2.237993      2.499417
  N      -2.533153     -2.671343      3.749355
  C      -2.137021     -2.084433      4.871568
  C      -0.885196     -1.407302      5.187313
  O      -0.722180     -0.682392      6.134320
  Cl      0.557328     -1.916635      4.189502
  C      -6.142632     -5.885358      4.478012
  C      -7.109675     -6.796276      4.958025
  C      -8.387751     -6.345055      5.250075
  C      -8.736505     -4.994735      5.056358
  C      -7.799487     -4.085178      4.587679
  C      -6.488763     -4.517290      4.310028
  N      -5.477540     -3.727083      3.777790
  C      -5.648999     -2.389932      3.837288
  C      -5.169913     -1.497275      2.819024
  O      -4.882024     -1.746135      1.671817
  Cl     -5.105095      0.215011      3.432822
  C      -1.177798     -4.898858      5.573724
  C       0.160799     -4.956971      6.032034
  C       0.460780     -4.520279      7.308352
  C      -0.546665     -4.002479      8.154466
  C      -1.862975     -3.960257      7.738264
  C      -2.202757     -4.442899      6.456578
  N      -3.475332     -4.465857      5.918370
  C      -4.576739     -4.391505      6.695332
  C      -4.720184     -5.038500      7.974962
  O      -3.969302     -5.775029      8.569785
  Cl     -6.390100     -4.692034      8.645106
  H      -2.436120     -3.375774     -0.744793
  H      -1.372373     -1.206416     -1.161764
  H      -0.971685      0.398532      0.702467
  H      -1.538313     -0.226929      3.025560
  H      -2.794626     -2.162263      5.735872
  H      -6.854452     -7.843107      5.114915
  H      -9.131313     -7.046965      5.628800
  H      -9.753517     -4.661245      5.264296
  H      -8.091140     -3.052290      4.398510
  H      -6.292097     -1.959347      4.608404
  H       0.955479     -5.295738      5.369673
  H       1.495416     -4.537234      7.653239
  H      -0.278940     -3.615407      9.137988
  H      -2.632459     -3.532812      8.378714
  H      -5.485859     -3.986591      6.262240
  N      -7.044514     -5.687686      1.207864
  N      -7.999026     -5.027143      1.366531
  H      -8.966591     -5.474345      1.357897
74
Coordinates from ORCA-job orca E -7353.007829089463
  N      -3.172612     -4.241834      1.780352
  C      -3.611517     -5.179623      0.748606
  C      -3.734458     -6.568689      1.383493
  N      -2.887665     -6.578231      2.602676
  C      -3.126597     -7.746557      3.482630
  C      -4.511329     -7.619888      4.088187
  N      -4.862243     -6.201044      4.118823
  Mo     -3.503306     -4.735739      3.740501
  N      -1.610472     -5.239901      4.331752
  C      -0.670089     -5.919469      3.442764
  C      -1.443994     -6.476349      2.252324
  H      -0.161011     -6.718735      4.004176
  H       0.107509     -5.223021      3.089432
  H      -1.075848     -7.471277      1.958090
  H      -1.347628     -5.814665      1.387651
  H      -5.264124     -8.160731      3.491666
  H      -4.519573     -8.057044      5.099890
  H      -3.010467     -8.680828      2.910984
  H      -2.358820     -7.718572      4.264481
  H      -2.895412     -5.196152     -0.084929
  H      -4.587374     -4.860827      0.347929
  H      -3.407598     -7.361013      0.691532
  H      -4.768011     -6.761988      1.685643
  C      -2.507063     -3.115484      1.421491
  C      -2.185378     -2.733021      0.094992
  C      -1.601999     -1.503444     -0.138992
  C      -1.362027     -0.595462      0.917481
  C      -1.656135     -0.948212      2.217507
  C      -2.160299     -2.237261      2.498164
  N      -2.533159     -2.671060      3.748211
  C      -2.135690     -2.083692      4.869897
  C      -0.883038     -1.406915      5.183705
  O      -0.717834     -0.683294      6.131323
  Cl      0.557458     -1.916701      4.183644
  C      -6.141775     -5.884937      4.478479
  C      -7.108304     -6.795967      4.959261
  C      -8.386638     -6.345509      5.250788
  C      -8.736358     -4.996001      5.055829
  C      -7.799777     -4.086018      4.587134
  C      -6.488495     -4.517173      4.310281
  N      -5.477456     -3.726807      3.777810
  C      -5.649195     -2.389652      3.836672
  C      -5.170248     -1.497338      2.817769
  O      -4.882405     -1.747099      1.670676
  Cl     -5.106185      0.215272      3.430365
  C      -1.178443     -4.899548      5.575010
  C       0.159652     -4.959524      6.033768
  C       0.459180     -4.524272      7.310342
  C      -0.548152     -4.005667      8.156079
  C      -1.863850     -3.961602      7.739403
  C      -2.203591     -4.443246      6.457563
  N      -3.475904     -4.464532      5.918940
  C      -4.577752     -4.391145      6.695567
  C      -4.722989     -5.040167      7.974280
  O      -3.972507     -5.777137      8.568815
  Cl     -6.394436     -4.695460      8.643874
  H      -2.436662     -3.376766     -0.745467
  H      -1.374631     -1.206277     -1.163589
  H      -0.975514      0.400122      0.700065
  H      -1.540882     -0.225105      3.023498
  H      -2.792608     -2.159992      5.734325
  H      -6.852130     -7.842230      5.117092
  H      -9.129890     -7.047682      5.629896
  H      -9.753791     -4.663394      5.262896
  H      -8.092141     -3.054033      4.396811
  H      -6.292575     -1.958833      4.607430
  H       0.954262     -5.299164      5.371735
  H       1.493366     -4.542852      7.655579
  H      -0.280742     -3.619321      9.139711
  H      -2.632987     -3.533413      8.379672
  H      -5.486288     -3.985794      6.263114
  N      -7.040707     -5.684045      1.208721
  N      -7.992123     -5.020020      1.368789
  H      -8.961372     -5.464517      1.366364
74
Coordinates from ORCA-job orca E -7353.007840779948
  N      -3.172251     -4.242811      1.780158
  C      -3.611636     -5.181084      0.748882
  C      -3.733379     -6.570222      1.384078
  N      -2.886236     -6.579201      2.602887
  C      -3.124854     -7.748029      3.482655
  C      -4.509663     -7.621641      4.088596
  N      -4.861106     -6.202827      4.119314
  Mo     -3.502497     -4.736782      3.739931
  N      -1.610851     -5.240408      4.333285
  C      -0.669931     -5.917714      3.443486
  C      -1.442696     -6.475854      2.252987
  H      -0.159002     -6.716144      4.004307
  H       0.106013     -5.219567      3.089946
  H      -1.073380     -7.470590      1.959658
  H      -1.346795     -5.814333      1.388150
  H      -5.261999     -8.162937      3.491918
  H      -4.518421     -8.058936      5.100384
  H      -3.009165     -8.681289      2.909475
  H      -2.356855     -7.721847      4.264260
  H      -2.895689     -5.198090     -0.084838
  H      -4.588210     -4.863095      0.348821
  H      -3.406656     -7.362241      0.691726
  H      -4.766946     -6.764508      1.686234
  C      -2.508349     -3.115687      1.420514
  C      -2.187846     -2.733047      0.093935
  C      -1.605627     -1.502873     -0.140299
  C      -1.365796     -0.594859      0.916090
  C      -1.658613     -0.947890      2.216300
  C      -2.161711     -2.237441      2.497173
  N      -2.533691     -2.671954      3.747143
  C      -2.134396     -2.084722      4.868595
  C      -0.880002     -1.411248      5.181220
  O      -0.711431     -0.689950      6.130232
  Cl      0.557355     -1.921712      4.177379
  C      -6.140958     -5.887060      4.478418
  C      -7.107368     -6.798368      4.958927
  C      -8.385932     -6.348342      5.249807
  C      -8.736157     -4.999014      5.054975
  C      -7.799786     -4.088669      4.586895
  C      -6.488161     -4.519410      4.310444
  N      -5.477629     -3.729023      3.777569
  C      -5.649798     -2.391916      3.836363
  C      -5.172095     -1.499828      2.816520
  O      -4.885330     -1.750521      1.669178
  Cl     -5.107974      0.212874      3.428314
  C      -1.179652     -4.900298      5.576599
  C       0.158240     -4.960522      6.035640
  C       0.457451     -4.524225      7.311741
  C      -0.550019     -4.004232      8.156491
  C      -1.865475     -3.960430      7.739761
  C      -2.205222     -4.443296      6.458519
  N      -3.477275     -4.464094      5.919505
  C      -4.579368     -4.390372      6.695409
  C      -4.725816     -5.037916      7.974977
  O      -3.974595     -5.771541      8.572789
  Cl     -6.400040     -4.696645      8.640643
  H      -2.438821     -3.377243     -0.746191
  H      -1.378994     -1.205548     -1.164972
  H      -0.980287      0.401142      0.698588
  H      -1.543377     -0.224789      3.022261
  H      -2.790904     -2.158928      5.733135
  H      -6.850515     -7.844434      5.116978
  H      -9.129115     -7.050751      5.628572
  H      -9.753830     -4.666841      5.261670
  H      -8.092309     -3.056855      4.396637
  H      -6.292510     -1.961091      4.607709
  H       0.952993     -5.301364      5.374346
  H       1.491438     -4.542985      7.657061
  H      -0.282897     -3.616492      9.139496
  H      -2.634432     -3.531098      8.379456
  H      -5.487487     -3.986286      6.262394
  N      -7.037170     -5.679198      1.202487
  N      -7.975512     -4.998524      1.368304
  H      -8.951847     -5.427899      1.389428
74
Coordinates from ORCA-job orca E -7353.007850770782
  N      -3.171270     -4.244222      1.780014
  C      -3.611446     -5.182575      0.748887
  C      -3.732578     -6.571738      1.384305
  N      -2.885684     -6.580471      2.603136
  C      -3.124388     -7.750164      3.482209
  C      -4.509289     -7.623748      4.088192
  N      -4.860680     -6.204911      4.119512
  Mo     -3.502307     -4.738313      3.739296
  N      -1.611347     -5.240798      4.333987
  C      -0.670171     -5.917157      3.444009
  C      -1.442145     -6.476603      2.253688
  H      -0.158201     -6.714905      4.004813
  H       0.105010     -5.218402      3.090022
  H      -1.072269     -7.471472      1.961533
  H      -1.346419     -5.815752      1.388339
  H      -5.261199     -8.164999      3.491000
  H      -4.518828     -8.061375      5.099744
  H      -3.008730     -8.682379      2.907461
  H      -2.356284     -7.725822      4.263794
  H      -2.895586     -5.200172     -0.084925
  H      -4.588490     -4.864857      0.349650
  H      -3.405606     -7.363436      0.691629
  H      -4.766393     -6.767164      1.685035
  C      -2.508168     -3.116686      1.419991
  C      -2.187410     -2.734496      0.093426
  C      -1.605775     -1.504024     -0.141045
  C      -1.367086     -0.595418      0.915104
  C      -1.660106     -0.948107      2.215374
  C      -2.162428     -2.237982      2.496564
  N      -2.534577     -2.672756      3.746396
  C      -2.135295     -2.085075      4.867764
  C      -0.880791     -1.411750      5.180310
  O      -0.712114     -0.691018      6.129817
  Cl      0.556306     -1.921449      4.176047
  C      -6.140825     -5.889398      4.477792
  C      -7.107732     -6.801053      4.957071
  C      -8.386431     -6.351303      5.247368
  C      -8.736468     -5.001735      5.053946
  C      -7.799762     -4.090994      4.587424
  C      -6.488111     -4.521710      4.310708
  N      -5.477707     -3.731101      3.777944
  C      -5.650040     -2.393967      3.836960
  C      -5.172467     -1.501785      2.816926
  O      -4.885631     -1.752810      1.669680
  Cl     -5.108618      0.210660      3.428079
  C      -1.180288     -4.899819      5.577082
  C       0.157598     -4.959762      6.036107
  C       0.456754     -4.521611      7.311518
  C      -0.550690     -3.999996      8.155243
  C      -1.866117     -3.957014      7.738834
  C      -2.206050     -4.441875      6.458444
  N      -3.478288     -4.463858      5.919710
  C      -4.580284     -4.391355      6.695994
  C      -4.725730     -5.037824      7.976467
  O      -3.972752     -5.767403      8.576611
  Cl     -6.402643     -4.702818      8.639346
  H      -2.437493     -3.379443     -0.746390
  H      -1.378737     -1.207090     -1.165729
  H      -0.982162      0.400838      0.697495
  H      -1.545695     -0.224441      3.020986
  H      -2.792137     -2.158519      5.731959
  H      -6.850830     -7.847202      5.114387
  H      -9.129979     -7.054035      5.624911
  H      -9.754183     -4.669641      5.260621
  H      -8.091987     -3.058863      4.398415
  H      -6.292256     -1.963040      4.608730
  H       0.952273     -5.302038      5.375474
  H       1.490620     -4.540252      7.656804
  H      -0.283613     -3.610389      9.137433
  H      -2.634923     -3.526587      8.377989
  H      -5.490002     -3.990889      6.262435
  N      -7.036897     -5.672531      1.198430
  N      -7.963529     -4.977605      1.370820
  H      -8.945291     -5.393109      1.412324
74
Coordinates from ORCA-job orca E -7353.007862477529
  N      -3.169103     -4.245604      1.779366
  C      -3.609684     -5.183376      0.747566
  C      -3.731312     -6.572542      1.382897
  N      -2.885322     -6.582133      2.602253
  C      -3.124854     -7.753374      3.479450
  C      -4.510011     -7.626819      4.084921
  N      -4.860370     -6.207866      4.118720
  Mo     -3.502312     -4.740429      3.737873
  N      -1.611938     -5.241765      4.333918
  C      -0.670525     -5.918627      3.444758
  C      -1.441509     -6.478400      2.254031
  H      -0.159174     -6.716472      4.005989
  H       0.105448     -5.220692      3.090928
  H      -1.071360     -7.473399      1.962724
  H      -1.345249     -5.817978      1.388484
  H      -5.261615     -8.166617      3.486196
  H      -4.521167     -8.065976      5.095588
  H      -3.008775     -8.684362      2.902733
  H      -2.356761     -7.731403      4.261342
  H      -2.893382     -5.201608     -0.085850
  H      -4.586554     -4.864911      0.348614
  H      -3.404758     -7.364175      0.689913
  H      -4.765916     -6.769315      1.681817
  C      -2.506245     -3.117618      1.419834
  C      -2.183781     -2.735780      0.093658
  C      -1.602355     -1.505146     -0.140390
  C      -1.365884     -0.596132      0.915731
  C      -1.660704     -0.948550      2.215678
  C      -2.162483     -2.238589      2.496609
  N      -2.536151     -2.673623      3.745978
  C      -2.138788     -2.085051      4.867635
  C      -0.885653     -1.409728      5.181433
  O      -0.720124     -0.687408      6.130286
  Cl      0.553926     -1.918498      4.180672
  C      -6.140296     -5.892551      4.477449
  C      -7.107367     -6.804672      4.955970
  C      -8.385668     -6.354951      5.247807
  C      -8.735443     -5.004671      5.057406
  C      -7.798897     -4.093656      4.591577
  C      -6.487739     -4.524621      4.312385
  N      -5.478348     -3.734098      3.777822
  C      -5.651224     -2.397056      3.835169
  C      -5.174466     -1.506175      2.813700
  O      -4.888414     -1.758703      1.666511
  Cl     -5.109538      0.206722      3.422755
  C      -1.181090     -4.899731      5.576964
  C       0.156886     -4.959341      6.036244
  C       0.456128     -4.518488      7.310866
  C      -0.551296     -3.994774      8.153241
  C      -1.866890     -3.952887      7.736993
  C      -2.206969     -4.440381      6.457512
  N      -3.479295     -4.463488      5.919029
  C      -4.580896     -4.391516      6.695494
  C      -4.725023     -5.035106      7.977651
  O      -3.969591     -5.759168      8.581644
  Cl     -6.404377     -4.706053      8.636685
  H      -2.432250     -3.381487     -0.745974
  H      -1.373583     -1.208534     -1.164753
  H      -0.981129      0.400221      0.698498
  H      -1.547932     -0.224382      3.020922
  H      -2.796765     -2.158897      5.731027
  H      -6.850603     -7.851273      5.111239
  H      -9.129170     -7.058068      5.624572
  H      -9.752763     -4.672349      5.265882
  H      -8.090877     -3.060861      4.404913
  H      -6.292347     -1.964714      4.607129
  H       0.951546     -5.303026      5.376277
  H       1.490202     -4.536496      7.656205
  H      -0.284109     -3.602654      9.134499
  H      -2.635670     -3.520868      8.375129
  H      -5.491156     -3.994809      6.261051
  N      -7.039792     -5.659544      1.198495
  N      -7.957662     -4.955081      1.378739
  H      -8.942524     -5.361413      1.435348
74
Coordinates from ORCA-job orca E -7353.007874240665
  N      -3.167242     -4.246845      1.779284
  C      -3.608421     -5.183834      0.746942
  C      -3.730624     -6.572890      1.381577
  N      -2.885900     -6.583426      2.601918
  C      -3.126408     -7.756139      3.477124
  C      -4.511261     -7.628886      4.083002
  N      -4.860763     -6.209837      4.117967
  Mo     -3.503031     -4.742086      3.737170
  N      -1.612028     -5.241941      4.332826
  C      -0.670844     -5.921247      3.445262
  C      -1.441742     -6.480750      2.254316
  H      -0.161497     -6.719691      4.007644
  H       0.107242     -5.225535      3.091519
  H      -1.072088     -7.476028      1.963327
  H      -1.344828     -5.820797      1.388451
  H      -5.263368     -8.167820      3.484203
  H      -4.522644     -8.068373      5.093371
  H      -3.010452     -8.686145      2.898892
  H      -2.357857     -7.736506      4.258906
  H      -2.892223     -5.202062     -0.086519
  H      -4.585222     -4.864873      0.348808
  H      -3.403892     -7.364635      0.688618
  H      -4.765641     -6.771453      1.677966
  C      -2.503321     -3.119165      1.420494
  C      -2.178059     -2.738290      0.094661
  C      -1.596217     -1.507867     -0.139195
  C      -1.362317     -0.597920      0.916609
  C      -1.660001     -0.949443      2.216187
  C      -2.161721     -2.239358      2.497185
  N      -2.537766     -2.673633      3.746283
  C      -2.144076     -2.083368      4.868076
  C      -0.893830     -1.403063      5.183866
  O      -0.734282     -0.676770      6.130636
  Cl      0.550643     -1.910553      4.189965
  C      -6.140688     -5.894639      4.476966
  C      -7.108406     -6.807096      4.954186
  C      -8.386580     -6.357513      5.246537
  C      -8.735784     -5.006734      5.058339
  C      -7.798750     -4.095455      4.593784
  C      -6.487952     -4.526565      4.313356
  N      -5.478861     -3.735938      3.778089
  C      -5.652193     -2.398884      3.833252
  C      -5.174991     -1.509334      2.810939
  O      -4.888158     -1.762863      1.664240
  Cl     -5.110822      0.204128      3.417638
  C      -1.180536     -4.897988      5.575485
  C       0.157596     -4.957092      6.034623
  C       0.457026     -4.514674      7.308783
  C      -0.550161     -3.989802      8.150624
  C      -1.865870     -3.948360      7.734615
  C      -2.206096     -4.437653      6.455729
  N      -3.478979     -4.463144      5.918268
  C      -4.580056     -4.393957      6.696027
  C      -4.720879     -5.036831      7.978926
  O      -3.962823     -5.757305      8.583384
  Cl     -6.401343     -4.714711      8.637678
  H      -2.424937     -3.384841     -0.744756
  H      -1.365065     -1.211996     -1.163245
  H      -0.977310      0.398324      0.699440
  H      -1.549309     -0.224322      3.020781
  H      -2.803602     -2.158607      5.730333
  H      -6.852413     -7.854141      5.107593
  H      -9.130477     -7.061074      5.621932
  H      -9.752857     -4.674317      5.267670
  H      -8.090265     -3.062171      4.408879
  H      -6.293324     -1.965050      4.604389
  H       0.951917     -5.301671      5.374765
  H       1.491054     -4.532636      7.654166
  H      -0.282779     -3.596731      9.131465
  H      -2.634819     -3.515774      8.372274
  H      -5.493033     -4.002477      6.260923
  N      -7.045345     -5.647045      1.201710
  N      -7.957720     -4.937200      1.389041
  H      -8.943577     -5.338197      1.455248
74
Coordinates from ORCA-job orca E -7353.007885683322
  N      -3.165112     -4.247353      1.779150
  C      -3.605706     -5.183234      0.745698
  C      -3.729580     -6.572275      1.379113
  N      -2.886406     -6.584514      2.600701
  C      -3.128237     -7.758292      3.473892
  C      -4.512741     -7.630456      4.080105
  N      -4.861158     -6.211284      4.116594
  Mo     -3.503650     -4.743419      3.736400
  N      -1.611717     -5.242669      4.331121
  C      -0.670841     -5.925706      3.445826
  C      -1.441736     -6.483189      2.253948
  H      -0.165301     -6.725655      4.009635
  H       0.110591     -5.233157      3.093158
  H      -1.072898     -7.478486      1.962013
  H      -1.343590     -5.822708      1.388625
  H      -5.265780     -8.167948      3.481196
  H      -4.523874     -8.070724      5.090038
  H      -3.012746     -8.687928      2.894804
  H      -2.359297     -7.740260      4.255587
  H      -2.889179     -5.200944     -0.087430
  H      -4.581843     -4.863073      0.347172
  H      -3.402900     -7.364305      0.686341
  H      -4.765042     -6.771962      1.673873
  C      -2.499484     -3.120200      1.421790
  C      -2.170813     -2.739978      0.096490
  C      -1.588735     -1.509633     -0.136685
  C      -1.358105     -0.598819      0.919096
  C      -1.659194     -0.949768      2.218094
  C      -2.160650     -2.239716      2.498651
  N      -2.539396     -2.673286      3.747384
  C      -2.150479     -2.081344      4.869523
  C      -0.904150     -1.394198      5.187663
  O      -0.752117     -0.662724      6.131445
  Cl      0.546619     -1.900603      4.202705
  C      -6.140675     -5.895966      4.477125
  C      -7.108215     -6.808375      4.954567
  C      -8.385851     -6.358465      5.249155
  C      -8.734703     -5.007196      5.062737
  C      -7.797935     -4.096211      4.597195
  C      -6.487826     -4.527768      4.314438
  N      -5.479565     -3.737550      3.776996
  C      -5.653650     -2.400582      3.828158
  C      -5.176258     -1.513552      2.803959
  O      -4.888540     -1.769137      1.658030
  Cl     -5.112928      0.201634      3.406918
  C      -1.179821     -4.897622      5.573614
  C       0.158337     -4.956711      6.032897
  C       0.458075     -4.513334      7.306863
  C      -0.548804     -3.987590      8.148517
  C      -1.864685     -3.946076      7.732284
  C      -2.204929     -4.436526      6.453658
  N      -3.478081     -4.463384      5.916921
  C      -4.578655     -4.395431      6.695285
  C      -4.717346     -5.037395      7.978638
  O      -3.957261     -5.755825      8.583207
  Cl     -6.397782     -4.718162      8.637825
  H      -2.415664     -3.387116     -0.743115
  H      -1.354889     -1.214184     -1.160269
  H      -0.973006      0.397426      0.702248
  H      -1.551127     -0.223848      3.022327
  H      -2.811687     -2.158858      5.730521
  H      -6.852905     -7.855793      5.106527
  H      -9.129390     -7.061992      5.624966
  H      -9.751182     -4.674321      5.274342
  H      -8.089215     -3.062416      4.413711
  H      -6.295331     -1.964647      4.597592
  H       0.952465     -5.301419      5.372866
  H       1.492371     -4.530992      7.652328
  H      -0.281031     -3.594013      9.129239
  H      -2.633814     -3.512826      8.369274
  H      -5.492040     -4.006110      6.259950
  N      -7.053327     -5.633120      1.209340
  N      -7.967333     -4.926711      1.401268
  H      -8.951396     -5.331594      1.465607
74
Coordinates from ORCA-job orca E -7353.007895666668
  N      -3.164327     -4.247426      1.779513
  C      -3.604380     -5.182637      0.745609
  C      -3.728800     -6.571961      1.377380
  N      -2.886578     -6.585193      2.599867
  C      -3.128964     -7.759013      3.472373
  C      -4.512942     -7.630815      4.079621
  N      -4.861342     -6.211616      4.115850
  Mo     -3.504190     -4.743912      3.736334
  N      -1.610939     -5.242940      4.329458
  C      -0.670481     -5.929261      3.445922
  C      -1.441674     -6.484482      2.253236
  H      -0.168432     -6.730585      4.011005
  H       0.113704     -5.239228      3.094322
  H      -1.073471     -7.479532      1.959636
  H      -1.342881     -5.822889      1.388784
  H      -5.267064     -8.168164      3.481842
  H      -4.522479     -8.070769      5.089854
  H      -3.014629     -8.688882      2.893384
  H      -2.359536     -7.741546      4.253622
  H      -2.888343     -5.199159     -0.087913
  H      -4.580440     -4.862268      0.347131
  H      -3.401356     -7.363836      0.684703
  H      -4.764050     -6.772785      1.671235
  C      -2.496875     -3.121032      1.423193
  C      -2.165872     -2.741201      0.098244
  C      -1.583508     -1.510980     -0.134547
  C      -1.354772     -0.599618      0.921134
  C      -1.658121     -0.950159      2.219719
  C      -2.159634     -2.240065      2.500071
  N      -2.540528     -2.672641      3.748659
  C      -2.155763     -2.079381      4.871094
  C      -0.912794     -1.386620      5.191330
  O      -0.766920     -0.650535      6.132393
  Cl      0.543105     -1.892597      4.213920
  C      -6.140725     -5.896125      4.477720
  C      -7.107923     -6.808340      4.955710
  C      -8.385494     -6.358423      5.251027
  C      -8.734389     -5.007296      5.064247
  C      -7.797765     -4.096438      4.597698
  C      -6.487802     -4.527955      4.314643
  N      -5.480044     -3.738270      3.775581
  C      -5.654996     -2.401315      3.822544
  C      -5.177740     -1.516952      2.796175
  O      -4.889000     -1.774871      1.651045
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  C      -1.178596     -4.897222      5.571712
  C       0.159425     -4.956618      6.031107
  C       0.459208     -4.513931      7.305290
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  C      -1.863132     -3.945675      7.730682
  C      -2.203250     -4.436000      6.451957
  N      -3.476691     -4.463981      5.915963
  C      -4.577039     -4.397155      6.694818
  C      -4.714058     -5.039463      7.978036
  O      -3.953128     -5.758345      8.580896
  Cl     -6.393142     -4.720128      8.639811
  H      -2.409535     -3.388373     -0.741658
  H      -1.348035     -1.215779     -1.157840
  H      -0.969538      0.396553      0.704320
  H      -1.551690     -0.223834      3.023723
  H      -2.818370     -2.158592      5.730992
  H      -6.853070     -7.855829      5.107618
  H      -9.128833     -7.062012      5.627298
  H      -9.750745     -4.674557      5.276401
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  H      -6.297885     -1.963622      4.589853
  H       0.953403     -5.301113      5.370809
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  H      -2.632533     -3.512576      8.367521
  H      -5.490941     -4.008405      6.259605
  N      -7.059589     -5.622658      1.216725
  N      -7.975040     -4.918955      1.411066
  H      -8.957474     -5.326989      1.474901
74
Coordinates from ORCA-job orca E -7353.007904023678
  N      -3.163831     -4.247416      1.779764
  C      -3.603327     -5.182111      0.745490
  C      -3.727805     -6.572194      1.375719
  N      -2.886191     -6.585905      2.598704
  C      -3.128652     -7.759064      3.471523
  C      -4.512126     -7.630860      4.079879
  N      -4.860927     -6.211717      4.115523
  Mo     -3.504325     -4.744156      3.736131
  N      -1.610102     -5.243560      4.328282
  C      -0.670017     -5.932095      3.445818
  C      -1.441238     -6.484930      2.252212
  H      -0.170846     -6.734613      4.011773
  H       0.116133     -5.243717      3.095341
  H      -1.073279     -7.479499      1.956586
  H      -1.342089     -5.821651      1.389060
  H      -5.267052     -8.168513      3.483322
  H      -4.519768     -8.070497      5.090437
  H      -3.015836     -8.689507      2.893028
  H      -2.358910     -7.741421      4.252336
  H      -2.887859     -5.197507     -0.088495
  H      -4.579379     -4.861504      0.346894
  H      -3.399161     -7.363400      0.682828
  H      -4.762801     -6.773770      1.669602
  C      -2.494911     -3.121658      1.424219
  C      -2.162098     -2.742151      0.099569
  C      -1.579860     -1.511795     -0.132930
  C      -1.353070     -0.599764      0.922715
  C      -1.657987     -0.950027      2.221018
  C      -2.159126     -2.240206      2.501207
  N      -2.541432     -2.672241      3.749663
  C      -2.159913     -2.078147      4.872432
  C      -0.919714     -1.380588      5.194095
  O      -0.778375     -0.641163      6.133105
  Cl      0.539980     -1.886143      4.222283
  C      -6.140164     -5.896127      4.478419
  C      -7.106471     -6.808160      4.957731
  C      -8.383992     -6.358292      5.253873
  C      -8.733338     -5.007500      5.066081
  C      -7.797414     -4.096808      4.597609
  C      -6.487493     -4.528150      4.314177
  N      -5.480259     -3.738932      3.773388
  C      -5.656331     -2.401953      3.816539
  C      -5.179130     -1.519738      2.788253
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  Cl     -5.121715      0.199702      3.383146
  C      -1.177846     -4.898105      5.570461
  C       0.159858     -4.958375      6.030286
  C       0.459580     -4.516449      7.304674
  C      -0.546768     -3.990332      8.146957
  C      -1.862311     -3.946785      7.729644
  C      -2.202290     -4.436772      6.450816
  N      -3.475726     -4.464939      5.915148
  C      -4.576020     -4.397772      6.693963
  C      -4.713086     -5.040820      7.976720
  O      -3.952330     -5.761291      8.577942
  Cl     -6.391221     -4.719390      8.640507
  H      -2.404348     -3.389330     -0.740819
  H      -1.343246     -1.216863     -1.156058
  H      -0.968190      0.396588      0.705890
  H      -1.553178     -0.223255      3.024961
  H      -2.823591     -2.158518      5.731360
  H      -6.851285     -7.855353      5.110675
  H      -9.126621     -7.061644      5.631735
  H      -9.749544     -4.674809      5.279149
  H      -8.089380     -3.063570      4.412848
  H      -6.300862     -1.963069      4.581667
  H       0.953899     -5.302942      5.370088
  H       1.493634     -4.535348      7.650627
  H      -0.278683     -3.598432      9.128251
  H      -2.631774     -3.513424      8.366205
  H      -5.489312     -4.007279      6.259361
  N      -7.064817     -5.612639      1.223410
  N      -7.981670     -4.911322      1.418660
  H      -8.962959     -5.321998      1.483788
74
Coordinates from ORCA-job orca E -7353.007910748516
  N      -3.164125     -4.247466      1.779687
  C      -3.603692     -5.182099      0.745497
  C      -3.726787     -6.573190      1.374628
  N      -2.885172     -6.586435      2.597547
  C      -3.126947     -7.758487      3.471664
  C      -4.510183     -7.630713      4.080972
  N      -4.859996     -6.211737      4.115695
  Mo     -3.504252     -4.744029      3.735751
  N      -1.609416     -5.243850      4.327719
  C      -0.669470     -5.932752      3.445355
  C      -1.440450     -6.484143      2.251125
  H      -0.171510     -6.735821      4.011552
  H       0.117262     -5.244730      3.095555
  H      -1.072036     -7.478068      1.953786
  H      -1.341668     -5.819214      1.389188
  H      -5.265279     -8.169484      3.485593
  H      -4.516164     -8.069734      5.091999
  H      -3.015223     -8.689634      2.894002
  H      -2.357117     -7.739850      4.252106
  H      -2.889136     -5.196572     -0.089295
  H      -4.580258     -4.861920      0.347461
  H      -3.396563     -7.363180      0.681177
  H      -4.761376     -6.775625      1.669076
  C      -2.494556     -3.121948      1.424379
  C      -2.161140     -2.742444      0.099937
  C      -1.578847     -1.512014     -0.132436
  C      -1.352560     -0.599904      0.923175
  C      -1.657877     -0.950155      2.221358
  C      -2.159051     -2.240435      2.501478
  N      -2.541981     -2.672299      3.749847
  C      -2.162044     -2.078030      4.872984
  C      -0.923245     -1.378456      5.195610
  O      -0.784035     -0.637530      6.133767
  Cl      0.538173     -1.883868      4.226391
  C      -6.139113     -5.896160      4.479394
  C      -7.104473     -6.808257      4.960118
  C      -8.382151     -6.358809      5.256369
  C      -8.732248     -5.008532      5.067179
  C      -7.797077     -4.097593      4.597378
  C      -6.486914     -4.528365      4.314046
  N      -5.480301     -3.739578      3.771499
  C      -5.657650     -2.402573      3.811564
  C      -5.181405     -1.522173      2.781297
  O      -4.890050     -1.784591      1.637840
  Cl     -5.126816      0.199003      3.372707
  C      -1.177659     -4.899137      5.570023
  C       0.159676     -4.960441      6.030556
  C       0.458921     -4.519664      7.305306
  C      -0.547507     -3.993360      8.147510
  C      -1.862645     -3.948729      7.729466
  C      -2.202303     -4.437898      6.450360
  N      -3.475578     -4.465703      5.914558
  C      -4.576033     -4.397356      6.693072
  C      -4.714050     -5.041147      7.975470
  O      -3.954549     -5.763939      8.575492
  Cl     -6.390928     -4.715740      8.640879
  H      -2.402730     -3.389277     -0.740870
  H      -1.341926     -1.217264     -1.155528
  H      -0.967772      0.396496      0.706365
  H      -1.553465     -0.223424      3.025329
  H      -2.826388     -2.158806      5.731303
  H      -6.848466     -7.855128      5.114278
  H      -9.124242     -7.062278      5.635348
  H      -9.748604     -4.676321      5.280171
  H      -8.090027     -3.065075      4.411329
  H      -6.302976     -1.962696      4.575371
  H       0.954008     -5.305381      5.370878
  H       1.492630     -4.539625      7.651794
  H      -0.279690     -3.602265      9.129077
  H      -2.632228     -3.515371      8.365936
  H      -5.488477     -4.004066      6.259189
  N      -7.066888     -5.604308      1.227245
  N      -7.982321     -4.901409      1.422510
  H      -8.963714     -5.310810      1.495285
74
Coordinates from ORCA-job orca E -7353.007914925698
  N      -3.164358     -4.247764      1.779142
  C      -3.604625     -5.182498      0.745205
  C      -3.725874     -6.574460      1.373977
  N      -2.884141     -6.586741      2.596585
  C      -3.125043     -7.757826      3.472190
  C      -4.508198     -7.630544      4.082061
  N      -4.858992     -6.211816      4.116015
  Mo     -3.504140     -4.743770      3.735071
  N      -1.609113     -5.243933      4.327640
  C      -0.669073     -5.931894      3.444799
  C      -1.439699     -6.483005      2.250325
  H      -0.170849     -6.734956      4.010748
  H       0.117305     -5.243437      3.095113
  H      -1.070537     -7.476429      1.952109
  H      -1.341551     -5.817077      1.389078
  H      -5.263022     -8.170552      3.487492
  H      -4.513241     -8.068909      5.093422
  H      -3.013668     -8.689538      2.895337
  H      -2.355244     -7.737855      4.252448
  H      -2.890894     -5.196570     -0.090319
  H      -4.581807     -4.862818      0.348173
  H      -3.394126     -7.363154      0.679874
  H      -4.760190     -6.777553      1.669014
  C      -2.494814     -3.122190      1.423718
  C      -2.161164     -2.742847      0.099382
  C      -1.578861     -1.512323     -0.133040
  C      -1.352944     -0.600036      0.922505
  C      -1.658300     -0.950206      2.220714
  C      -2.159390     -2.240587      2.500904
  N      -2.542296     -2.672650      3.749249
  C      -2.162615     -2.078456      4.872560
  C      -0.924321     -1.378144      5.195387
  O      -0.785673     -0.636963      6.133425
  Cl      0.537498     -1.883369      4.226805
  C      -6.138025     -5.896435      4.479891
  C      -7.102656     -6.808697      4.961887
  C      -8.380352     -6.359560      5.258377
  C      -8.731016     -5.009532      5.068463
  C      -7.796565     -4.098411      4.597629
  C      -6.486336     -4.528845      4.313802
  N      -5.480074     -3.740102      3.770237
  C      -5.658430     -2.403036      3.809212
  C      -5.182557     -1.522846      2.778439
  O      -4.890028     -1.786009      1.635433
  Cl     -5.130519      0.198787      3.368300
  C      -1.178124     -4.900259      5.570267
  C       0.158921     -4.962500      6.031580
  C       0.457638     -4.522487      7.306658
  C      -0.549070     -3.996024      8.148465
  C      -1.863915     -3.950871      7.729873
  C      -2.203232     -4.439179      6.450394
  N      -3.476154     -4.466059      5.914047
  C      -4.576750     -4.396046      6.692276
  C      -4.716464     -5.041067      7.973959
  O      -3.958737     -5.766497      8.573038
  Cl     -6.392848     -4.712181      8.639897
  H      -2.402250     -3.389614     -0.741649
  H      -1.341818     -1.217920     -1.156198
  H      -0.968311      0.396483      0.705744
  H      -1.554104     -0.223346      3.024673
  H      -2.827137     -2.159419      5.730644
  H      -6.845622     -7.855171      5.117114
  H      -9.121856     -7.062940      5.638555
  H      -9.747347     -4.677377      5.281873
  H      -8.090269     -3.066006      4.411466
  H      -6.304074     -1.962996      4.572680
  H       0.953633     -5.307876      5.372551
  H       1.491138     -4.543147      7.653671
  H      -0.281625     -3.605164      9.130198
  H      -2.633512     -3.517465      8.366277
  H      -5.488232     -3.999630      6.259204
  N      -7.066856     -5.598624      1.228662
  N      -7.980788     -4.893624      1.422908
  H      -8.962561     -5.301004      1.503816
74
Coordinates from ORCA-job orca E -7353.007918185136
  N      -3.164553     -4.248003      1.778309
  C      -3.605720     -5.182938      0.744699
  C      -3.725105     -6.575428      1.373569
  N      -2.883281     -6.586710      2.595883
  C      -3.123448     -7.757265      3.472564
  C      -4.506656     -7.630388      4.082596
  N      -4.858151     -6.211868      4.116217
  Mo     -3.504035     -4.743379      3.734268
  N      -1.609129     -5.243736      4.327766
  C      -0.668791     -5.930196      3.444315
  C      -1.439049     -6.481870      2.249867
  H      -0.169456     -6.732933      4.009720
  H       0.116811     -5.240989      3.094436
  H      -1.069059     -7.474978      1.951570
  H      -1.341512     -5.815701      1.388749
  H      -5.261090     -8.171348      3.488405
  H      -4.511506     -8.068240      5.094147
  H      -3.011636     -8.689327      2.896377
  H      -2.353724     -7.735988      4.252757
  H      -2.892620     -5.196860     -0.091408
  H      -4.583553     -4.863797      0.348889
  H      -3.392155     -7.363059      0.678938
  H      -4.759223     -6.779220      1.668899
  C      -2.495498     -3.122117      1.422668
  C      -2.162064     -2.742726      0.098401
  C      -1.579571     -1.512227     -0.134028
  C      -1.353329     -0.600168      0.921509
  C      -1.658462     -0.950428      2.219763
  C      -2.159745     -2.240685      2.499941
  N      -2.542411     -2.673099      3.748281
  C      -2.162287     -2.079085      4.871673
  C      -0.923984     -1.379042      5.194467
  O      -0.785266     -0.638020      6.132648
  Cl      0.537661     -1.884184      4.225712
  C      -6.136976     -5.896665      4.480519
  C      -7.101184     -6.809119      4.963565
  C      -8.378793     -6.360234      5.260412
  C      -8.729840     -5.010292      5.070237
  C      -7.795876     -4.098980      4.598872
  C      -6.485685     -4.529165      4.314341
  N      -5.479832     -3.740498      3.769765
  C      -5.658801     -2.403441      3.808319
  C      -5.183716     -1.523399      2.777115
  O      -4.891499     -1.787118      1.634067
  Cl     -5.131875      0.198282      3.366165
  C      -1.178853     -4.900967      5.570836
  C       0.158010     -4.963919      6.032870
  C       0.456144     -4.524745      7.308380
  C      -0.550991     -3.998470      8.149766
  C      -1.865569     -3.952842      7.730664
  C      -2.204483     -4.440101      6.450634
  N      -3.477053     -4.465857      5.913505
  C      -4.577827     -4.394250      6.691529
  C      -4.719101     -5.040422      7.972515
  O      -3.963318     -5.768471      8.570924
  Cl     -6.394660     -4.707984      8.638833
  H      -2.403241     -3.389392     -0.742636
  H      -1.342611     -1.217990     -1.157230
  H      -0.968519      0.396313      0.704950
  H      -1.553897     -0.223683      3.023713
  H      -2.826687     -2.160364      5.729826
  H      -6.843445     -7.855492      5.118988
  H      -9.120015     -7.063732      5.641129
  H      -9.746162     -4.678225      5.283826
  H      -8.090167     -3.066796      4.412664
  H      -6.303619     -1.963121      4.572367
  H       0.953060     -5.309517      5.374346
  H       1.489429     -4.546086      7.655957
  H      -0.284098     -3.608083      9.131818
  H      -2.635274     -3.519685      8.367135
  H      -5.488458     -3.995030      6.259053
  N      -7.065127     -5.594732      1.229015
  N      -7.978457     -4.888486      1.421498
  H      -8.960181     -5.294810      1.508601
74
Coordinates from ORCA-job orca E -7353.007920769698
  N      -3.164394     -4.248265      1.777405
  C      -3.606573     -5.183295      0.744143
  C      -3.724419     -6.576081      1.373164
  N      -2.882781     -6.586544      2.595439
  C      -3.122487     -7.757018      3.472619
  C      -4.505629     -7.630276      4.082865
  N      -4.857553     -6.211928      4.116162
  Mo     -3.503996     -4.743064      3.733413
  N      -1.609359     -5.243555      4.327843
  C      -0.668617     -5.928562      3.443911
  C      -1.438620     -6.481202      2.249634
  H      -0.167901     -6.730874      4.008725
  H       0.116173     -5.238577      3.093732
  H      -1.068017     -7.474224      1.951804
  H      -1.341453     -5.815408      1.388175
  H      -5.259951     -8.171897      3.489117
  H      -4.510435     -8.067540      5.094603
  H      -3.010057     -8.689188      2.896817
  H      -2.352632     -7.734869      4.252657
  H      -2.894131     -5.197052     -0.092545
  H      -4.585027     -4.864532      0.349773
  H      -3.390284     -7.362876      0.678194
  H      -4.758393     -6.780815      1.668238
  C      -2.495851     -3.122085      1.421593
  C      -2.162523     -2.742707      0.097348
  C      -1.579979     -1.512203     -0.135081
  C      -1.353708     -0.600231      0.920460
  C      -1.658799     -0.950544      2.218770
  C      -2.160066     -2.240713      2.498929
  N      -2.542552     -2.673457      3.747310
  C      -2.162083     -2.079403      4.870648
  C      -0.923911     -1.379193      5.193261
  O      -0.785451     -0.637885      6.131254
  Cl      0.537817     -1.884447      4.224890
  C      -6.136163     -5.896928      4.480893
  C      -7.100115     -6.809414      4.964972
  C      -8.377492     -6.360549      5.262493
  C      -8.728724     -5.010547      5.072296
  C      -7.795117     -4.099294      4.600260
  C      -6.485163     -4.529521      4.314710
  N      -5.479575     -3.740813      3.769505
  C      -5.658725     -2.403730      3.808343
  C      -5.183968     -1.523404      2.777252
  O      -4.891912     -1.787016      1.634115
  Cl     -5.132015      0.197922      3.366145
  C      -1.179648     -4.901538      5.571366
  C       0.157105     -4.965004      6.033948
  C       0.454775     -4.526662      7.309907
  C      -0.552772     -4.000810      8.151005
  C      -1.867176     -3.954728      7.731460
  C      -2.205717     -4.440911      6.450814
  N      -3.477929     -4.465358      5.912856
  C      -4.578809     -4.392235      6.690804
  C      -4.721554     -5.039856      7.970806
  O      -3.967638     -5.770644      8.568322
  Cl     -6.396458     -4.704503      8.637471
  H      -2.403816     -3.389512     -0.743553
  H      -1.343009     -1.218076     -1.158312
  H      -0.968830      0.396270      0.704134
  H      -1.554128     -0.223732      3.022662
  H      -2.826233     -2.161314      5.728959
  H      -6.841956     -7.855677      5.120423
  H      -9.118397     -7.063933      5.643956
  H      -9.744855     -4.678270      5.286544
  H      -8.089585     -3.066950      4.414521
  H      -6.302607     -1.963430      4.573269
  H       0.952387     -5.310459      5.375627
  H       1.487953     -4.548459      7.657940
  H      -0.286389     -3.610997      9.133464
  H      -2.636971     -3.521883      8.368023
  H      -5.488584     -3.990365      6.258839
  N      -7.062636     -5.591732      1.229513
  N      -7.976853     -4.885971      1.419808
  H      -8.957904     -5.293026      1.510597
74
Coordinates from ORCA-job orca E -7353.007922830127
  N      -3.163986     -4.248329      1.776635
  C      -3.606967     -5.183381      0.743692
  C      -3.723731     -6.576234      1.372772
  N      -2.882462     -6.586241      2.595219
  C      -3.121966     -7.756971      3.472363
  C      -4.504896     -7.630230      4.082927
  N      -4.857000     -6.211968      4.116059
  Mo     -3.503797     -4.742781      3.732646
  N      -1.609660     -5.243499      4.327964
  C      -0.668449     -5.927203      3.443669
  C      -1.438252     -6.480885      2.249592
  H      -0.166302     -6.729065      4.007864
  H       0.115492     -5.236363      3.093257
  H      -1.067269     -7.473990      1.952561
  H      -1.341152     -5.815842      1.387549
  H      -5.259409     -8.172160      3.489644
  H      -4.509614     -8.067050      5.094794
  H      -3.008920     -8.689088      2.896673
  H      -2.351815     -7.734388      4.252158
  H      -2.895192     -5.196879     -0.093565
  H      -4.585990     -4.864803      0.350695
  H      -3.388611     -7.362445      0.677631
  H      -4.757555     -6.782002      1.667376
  C      -2.495988     -3.121844      1.420716
  C      -2.162958     -2.742296      0.096470
  C      -1.580544     -1.511733     -0.135886
  C      -1.354173     -0.599979      0.919732
  C      -1.659125     -0.950496      2.218081
  C      -2.160264     -2.240599      2.498120
  N      -2.542595     -2.673694      3.746557
  C      -2.161900     -2.079497      4.869767
  C      -0.924046     -1.378616      5.191987
  O      -0.786134     -0.636422      6.129345
  Cl      0.537997     -1.884236      4.224464
  C      -6.135322     -5.897089      4.481601
  C      -7.099058     -6.809467      4.966764
  C      -8.376174     -6.360535      5.265038
  C      -8.727566     -5.010516      5.074600
  C      -7.794238     -4.099442      4.601716
  C      -6.484542     -4.529768      4.315317
  N      -5.479322     -3.741186      3.769254
  C      -5.658363     -2.404108      3.808078
  C      -5.184216     -1.524074      2.776616
  O      -4.893148     -1.787987      1.633273
  Cl     -5.131071      0.197188      3.365043
  C      -1.180377     -4.902185      5.571933
  C       0.156257     -4.966177      6.034967
  C       0.453556     -4.528863      7.311440
  C      -0.554328     -4.003575      8.152431
  C      -1.868565     -3.956721      7.732337
  C      -2.206740     -4.441705      6.451010
  N      -3.478609     -4.464593      5.912168
  C      -4.579663     -4.389972      6.689983
  C      -4.723871     -5.039228      7.968827
  O      -3.971952     -5.773165      8.565131
  Cl     -6.397618     -4.700397      8.636357
  H      -2.404514     -3.389259     -0.744226
  H      -1.343688     -1.217465     -1.159100
  H      -0.969280      0.396547      0.703673
  H      -1.554295     -0.223707      3.021939
  H      -2.825595     -2.162298      5.728358
  H      -6.840782     -7.855752      5.122035
  H      -9.116863     -7.063826      5.647177
  H      -9.743536     -4.678135      5.289378
  H      -8.088741     -3.067127      4.415973
  H      -6.301037     -1.963605      4.573927
  H       0.951660     -5.311210      5.376592
  H       1.486638     -4.551151      7.659903
  H      -0.288416     -3.614677      9.135444
  H      -2.638465     -3.524203      8.368981
  H      -5.488445     -3.985212      6.258424
  N      -7.060132     -5.588267      1.230773
  N      -7.976758     -4.884829      1.418182
  H      -8.956432     -5.294616      1.510577
74
Coordinates from ORCA-job orca E -7353.007924701785
  N      -3.163456     -4.248269      1.776104
  C      -3.607102     -5.183229      0.743473
  C      -3.723156     -6.576161      1.372335
  N      -2.882359     -6.585908      2.595159
  C      -3.121802     -7.757084      3.471877
  C      -4.504408     -7.630215      4.083071
  N      -4.856618     -6.211965      4.115739
  Mo     -3.503603     -4.742620      3.732003
  N      -1.610011     -5.243506      4.327916
  C      -0.668314     -5.926126      3.443329
  C      -1.438027     -6.480847      2.249513
  H      -0.164803     -6.727479      4.007046
  H       0.114689     -5.234273      3.092760
  H      -1.066966     -7.474196      1.953454
  H      -1.340830     -5.816759      1.386726
  H      -5.259424     -8.172389      3.490542
  H      -4.508676     -8.066448      5.095208
  H      -3.008531     -8.688925      2.895915
  H      -2.351182     -7.734784      4.251262
  H      -2.896192     -5.196280     -0.094500
  H      -4.586640     -4.864661      0.351807
  H      -3.386955     -7.361985      0.677230
  H      -4.756820     -6.783305      1.666099
  C      -2.495691     -3.121667      1.420147
  C      -2.162878     -2.741981      0.095850
  C      -1.580739     -1.511314     -0.136465
  C      -1.354478     -0.599634      0.919226
  C      -1.659355     -0.950307      2.217619
  C      -2.160203     -2.240447      2.497577
  N      -2.542623     -2.673727      3.746087
  C      -2.162171     -2.079280      4.869182
  C      -0.924910     -1.377198      5.191117
  O      -0.788054     -0.633370      6.127311
  Cl      0.537896     -1.883686      4.225326
  C      -6.134657     -5.897102      4.482228
  C      -7.098105     -6.809175      4.968559
  C      -8.374916     -6.360005      5.267765
  C      -8.726450     -5.010010      5.076924
  C      -7.793427     -4.099276      4.602833
  C      -6.484028     -4.529841      4.315624
  N      -5.479169     -3.741427      3.768786
  C      -5.657820     -2.404280      3.807634
  C      -5.184106     -1.524663      2.775701
  O      -4.893740     -1.788886      1.632260
  Cl     -5.130186      0.196714      3.363516
  C      -1.180967     -4.902775      5.572221
  C       0.155538     -4.967172      6.035549
  C       0.452474     -4.531166      7.312568
  C      -0.555692     -4.006672      8.153716
  C      -1.869736     -3.958789      7.733012
  C      -2.207527     -4.442508      6.451045
  N      -3.479097     -4.463820      5.911456
  C      -4.580314     -4.387890      6.689163
  C      -4.725807     -5.038999      7.966731
  O      -3.975661     -5.776168      8.561422
  Cl     -6.398321     -4.696840      8.635645
  H      -2.404592     -3.389161     -0.744647
  H      -1.344004     -1.216833     -1.159661
  H      -0.969750      0.396976      0.703309
  H      -1.554639     -0.223407      3.021411
  H      -2.825465     -2.163016      5.728005
  H      -6.839902     -7.855411      5.123948
  H      -9.115277     -7.063019      5.650938
  H      -9.742201     -4.677482      5.292487
  H      -8.087784     -3.066904      4.416945
  H      -6.299677     -1.963705      4.574145
  H       0.951014     -5.311486      5.376903
  H       1.485421     -4.553934      7.661400
  H      -0.290205     -3.619049      9.137365
  H      -2.639786     -3.526672      8.369763
  H      -5.487970     -3.980097      6.258105
  N      -7.057267     -5.585033      1.232864
  N      -7.977418     -4.885308      1.417043
  H      -8.955236     -5.299250      1.509694
74
Coordinates from ORCA-job orca E -7353.007926141308
  N      -3.163007     -4.248041      1.776179
  C      -3.606885     -5.182884      0.743729
  C      -3.722870     -6.575673      1.372350
  N      -2.882313     -6.585635      2.595403
  C      -3.121765     -7.757219      3.471581
  C      -4.504026     -7.630395      4.083326
  N      -4.856194     -6.212107      4.115906
  Mo     -3.503182     -4.742613      3.731878
  N      -1.610213     -5.243752      4.328143
  C      -0.668167     -5.925565      3.443197
  C      -1.437877     -6.480959      2.249612
  H      -0.163561     -6.726445      4.006560
  H       0.113856     -5.232629      3.092558
  H      -1.067020     -7.474597      1.954350
  H      -1.340485     -5.817613      1.386286
  H      -5.259449     -8.172483      3.491240
  H      -4.507747     -8.066549      5.095501
  H      -3.008547     -8.688781      2.895140
  H      -2.350768     -7.735480      4.250703
  H      -2.896648     -5.195633     -0.094795
  H      -4.586700     -4.864151      0.352723
  H      -3.386375     -7.361473      0.677325
  H      -4.756416     -6.783491      1.665774
  C      -2.495464     -3.121356      1.420119
  C      -2.163161     -2.741446      0.095738
  C      -1.581483     -1.510601     -0.136583
  C      -1.355162     -0.599025      0.919190
  C      -1.659649     -0.949907      2.217642
  C      -2.160141     -2.240167      2.497524
  N      -2.542388     -2.673661      3.746105
  C      -2.161842     -2.079107      4.869008
  C      -0.924928     -1.375853      5.190087
  O      -0.788382     -0.630675      6.125197
  Cl      0.538088     -1.883297      4.225060
  C      -6.134109     -5.897228      4.483018
  C      -7.097340     -6.809065      4.970012
  C      -8.374104     -6.359824      5.269408
  C      -8.725842     -5.010014      5.077790
  C      -7.792994     -4.099470      4.602857
  C      -6.483613     -4.530077      4.315743
  N      -5.479053     -3.741845      3.768289
  C      -5.657447     -2.404669      3.806743
  C      -5.184272     -1.525784      2.774037
  O      -4.894552     -1.790613      1.630605
  Cl     -5.129951      0.196030      3.361008
  C      -1.181268     -4.903582      5.572644
  C       0.155096     -4.968396      6.036132
  C       0.451924     -4.533243      7.313485
  C      -0.556255     -4.009129      8.154850
  C      -1.870182     -3.960351      7.733666
  C      -2.207807     -4.443258      6.451334
  N      -3.479157     -4.463191      5.911223
  C      -4.580575     -4.386207      6.688613
  C      -4.727264     -5.038635      7.965224
  O      -3.978577     -5.778475      8.558558
  Cl     -6.398559     -4.693232      8.635372
  H      -2.404984     -3.388734     -0.744653
  H      -1.345103     -1.215788     -1.159769
  H      -0.970708      0.397673      0.703253
  H      -1.554869     -0.223034      3.021441
  H      -2.824441     -2.163355      5.728242
  H      -6.839246     -7.855247      5.125790
  H      -9.114335     -7.062699      5.653193
  H      -9.741600     -4.677652      5.293454
  H      -8.087290     -3.067300      4.416175
  H      -6.298959     -1.963924      4.573381
  H       0.950553     -5.312169      5.377214
  H       1.484821     -4.556263      7.662513
  H      -0.290850     -3.622350      9.138905
  H      -2.640231     -3.528253      8.370382
  H      -5.487214     -3.975811      6.257807
  N      -7.055865     -5.581893      1.234535
  N      -7.978698     -4.885058      1.415851
  H      -8.955055     -5.302193      1.509342
74
Coordinates from ORCA-job orca E -7353.007927255935
  N      -3.162895     -4.247850      1.776342
  C      -3.606862     -5.182587      0.743963
  C      -3.722866     -6.575465      1.372329
  N      -2.882339     -6.585442      2.595511
  C      -3.121720     -7.757237      3.471326
  C      -4.503852     -7.630466      4.083593
  N      -4.856091     -6.212124      4.115801
  Mo     -3.503062     -4.742654      3.731864
  N      -1.610379     -5.243655      4.328072
  C      -0.668111     -5.924913      3.442797
  C      -1.437853     -6.480869      2.249478
  H      -0.162752     -6.725317      4.006103
  H       0.113038     -5.231048      3.092071
  H      -1.067199     -7.474747      1.954782
  H      -1.340462     -5.817997      1.385782
  H      -5.259531     -8.172730      3.491933
  H      -4.506960     -8.066353      5.095974
  H      -3.008888     -8.688464      2.894324
  H      -2.350515     -7.736326      4.250224
  H      -2.897092     -5.195117     -0.094945
  H      -4.586755     -4.863673      0.353202
  H      -3.386075     -7.361375      0.677523
  H      -4.756370     -6.783957      1.665330
  C      -2.495155     -3.121290      1.420203
  C      -2.163020     -2.741413      0.095739
  C      -1.581501     -1.510519     -0.136707
  C      -1.355170     -0.598848      0.919030
  C      -1.659491     -0.949673      2.217535
  C      -2.159831     -2.240024      2.497513
  N      -2.542182     -2.673440      3.746136
  C      -2.161901     -2.078902      4.869040
  C      -0.925227     -1.375109      5.189972
  O      -0.789113     -0.628744      6.124169
  Cl      0.538167     -1.883636      4.225902
  C      -6.133890     -5.897085      4.483381
  C      -7.096872     -6.808707      4.970823
  C      -8.373531     -6.359283      5.270630
  C      -8.725378     -5.009557      5.078732
  C      -7.792771     -4.099172      4.603094
  C      -6.483442     -4.529902      4.315795
  N      -5.479133     -3.741815      3.767900
  C      -5.657297     -2.404562      3.806188
  C      -5.184342     -1.526136      2.772956
  O      -4.894635     -1.791377      1.629624
  Cl     -5.130313      0.196102      3.359313
  C      -1.181405     -4.903764      5.572613
  C       0.154857     -4.968671      6.036169
  C       0.451414     -4.534371      7.313794
  C      -0.556872     -4.010820      8.155439
  C      -1.870649     -3.961426      7.733912
  C      -2.208018     -4.443647      6.451355
  N      -3.479264     -4.462906      5.911047
  C      -4.580819     -4.385651      6.688305
  C      -4.728011     -5.039130      7.964330
  O      -3.979927     -5.780516      8.556516
  Cl     -6.398583     -4.692033      8.635684
  H      -2.404790     -3.388726     -0.744657
  H      -1.345288     -1.215638     -1.159923
  H      -0.970897      0.397888      0.702885
  H      -1.554809     -0.222683      3.021274
  H      -2.824290     -2.163324      5.728448
  H      -6.838880     -7.854846      5.127014
  H      -9.113557     -7.061985      5.655009
  H      -9.741089     -4.677245      5.294761
  H      -8.087047     -3.067060      4.415996
  H      -6.298875     -1.963722      4.572706
  H       0.950399     -5.311983      5.377109
  H       1.484151     -4.557621      7.663000
  H      -0.291618     -3.624927      9.139806
  H      -2.640868     -3.529636      8.370711
  H      -5.486842     -3.973617      6.257904
  N      -7.054144     -5.580500      1.235799
  N      -7.979118     -4.885958      1.415008
  H      -8.954389     -5.305589      1.509065
74
Coordinates from ORCA-job orca E -7353.007927400015
  N      -3.162955     -4.247729      1.776778
  C      -3.606846     -5.182439      0.744367
  C      -3.723130     -6.575159      1.372785
  N      -2.882339     -6.585373      2.595764
  C      -3.121594     -7.757186      3.471487
  C      -4.503701     -7.630672      4.083840
  N      -4.855928     -6.212333      4.116265
  Mo     -3.502891     -4.742755      3.732196
  N      -1.610397     -5.243674      4.328311
  C      -0.668079     -5.924542      3.442664
  C      -1.437885     -6.480775      2.249548
  H      -0.162211     -6.724605      4.005928
  H       0.112399     -5.230016      3.091798
  H      -1.067402     -7.474781      1.955100
  H      -1.340576     -5.818040      1.385759
  H      -5.259252     -8.172831      3.492045
  H      -4.506566     -8.066835      5.096089
  H      -3.008943     -8.688311      2.894185
  H      -2.350412     -7.736576      4.250454
  H      -2.897125     -5.195105     -0.094587
  H      -4.586635     -4.863367      0.353331
  H      -3.386883     -7.361370      0.678047
  H      -4.756658     -6.783315      1.666074
  C      -2.495238     -3.121190      1.420461
  C      -2.163398     -2.741354      0.095934
  C      -1.581990     -1.510422     -0.136659
  C      -1.355437     -0.598718      0.919019
  C      -1.659447     -0.949492      2.217582
  C      -2.159767     -2.239873      2.497655
  N      -2.541859     -2.673299      3.746307
  C      -2.161188     -2.078908      4.869102
  C      -0.924334     -1.374992      5.189346
  O      -0.787648     -0.628402      6.123232
  Cl      0.538608     -1.884161      4.224718
  C      -6.133826     -5.897281      4.483625
  C      -7.096780     -6.808955      4.970872
  C      -8.373617     -6.359681      5.270192
  C      -8.725581     -5.010099      5.077957
  C      -7.792982     -4.099593      4.602451
  C      -6.483463     -4.530170      4.315668
  N      -5.479191     -3.742022      3.767796
  C      -5.657502     -2.404771      3.805915
  C      -5.184631     -1.526456      2.772518
  O      -4.894563     -1.791808      1.629323
  Cl     -5.131482      0.195994      3.358625
  C      -1.181387     -4.904050      5.572846
  C       0.154831     -4.969070      6.036409
  C       0.451423     -4.534832      7.314048
  C      -0.556753     -4.011254      8.155792
  C      -1.870521     -3.961743      7.734217
  C      -2.207931     -4.443864      6.451667
  N      -3.479138     -4.462792      5.911320
  C      -4.580764     -4.385381      6.688350
  C      -4.728336     -5.039076      7.964246
  O      -3.980603     -5.781187      8.555995
  Cl     -6.398457     -4.690718      8.635983
  H      -2.405151     -3.388587     -0.744521
  H      -1.346006     -1.215534     -1.159918
  H      -0.971236      0.397999      0.702646
  H      -1.554563     -0.222550      3.021326
  H      -2.823129     -2.163124      5.728821
  H      -6.838721     -7.855004      5.127490
  H      -9.113689     -7.062434      5.654468
  H      -9.741438     -4.678020      5.293629
  H      -8.087368     -3.067616      4.414921
  H      -6.299405     -1.963891      4.572102
  H       0.950391     -5.312348      5.377362
  H       1.484166     -4.558025      7.663256
  H      -0.291333     -3.625400      9.140147
  H      -2.640680     -3.529852      8.370977
  H      -5.486475     -3.972514      6.258032
  N      -7.053903     -5.579360      1.235870
  N      -7.979171     -4.885006      1.413908
  H      -8.954171     -5.304887      1.510170
