%NProcShared=12
%mem=40Gb

#p BP86/gen maxdisk=150Gb EmpiricalDispersion=GD2

Optimization

0 1
Mo    9.073435   13.260621    8.319575
Mo    7.304263   10.112691    7.565803
Mo   10.981729   10.350648    7.039640
Mo   11.183298   13.857645   11.129701
Mo    7.662792   13.071686   11.618823
Mo    7.950509    7.186589    9.677435
Mo   11.617647    7.734367    9.137987
Mo   11.537639   10.860356   13.203954
Mo    8.220723   10.095157   13.742913
Mo   10.172282    7.531147   12.538759
Mo    6.029167    9.854795   10.760055
Mo   12.965691   10.813399    9.780583
 P    9.497451   10.347450   10.350129
 O    8.721414   14.400249    7.127379
 O    6.502076   10.100732    6.082981
 O   11.362315   10.540582    5.410944
 O   10.992268   15.785022   11.430131
 O    6.512268   14.137602   12.248955
 O    7.533072    5.594716    9.313116
 O   12.400692    6.284333    8.793526
 O   12.700325   11.226913   14.370761
 O    7.321554   10.146981   15.165290
 O   10.581191    6.103951   13.335505
 O    4.398926    9.798785   11.188562
 O   14.593104   11.274890    9.821745
 O   10.232037   14.205018    9.431497
 O    7.528608   13.837718    9.643099
 O    7.694400   11.892517    7.867213
 O   10.289820   12.151382    7.516407
 O    9.226584   14.024796   11.746181
 O    6.460343   11.666623   10.875024
 O    6.374774    7.914329   10.328187
 O    9.761647    7.283357    8.998513
 O   13.091568    8.914067    9.550453
 O   12.032660   12.479019   10.145378
 O    6.928380    9.565545   12.412821
 O    5.894753   10.000180    8.796287
 O    9.151004    9.859016    7.017721
 O   12.597942   10.970188    7.920255
 O   12.544042   10.500574   11.676249
 O    9.955653   10.716702   14.301280
 O    7.956207   11.882528   13.015331
 O   11.012113   12.519156   12.517821
 O   11.544010    8.566782    7.394760
 O    7.428474    7.988150    7.801169
 O   11.592015    8.742715   13.518934
 O    8.932880    8.314341   13.780051
 O    8.752856    7.033794   11.401695
 O   11.309618    7.586374   11.062966
 O    9.195017   11.851817   10.284054
 O    8.268086    9.571213    9.805694
 O    9.777275    9.893166   11.810934
 O   10.720662   10.008787    9.471197
 O   12.761932   14.246627   12.158119
 O   16.552584   15.143005   10.489038
 O   15.224133   13.041492   11.863215
 O   12.776332   14.925005    9.704442
 O   18.686951   15.664700   12.099106
 O   19.482512   13.228475   12.777022
 C   16.396378   15.206757   11.912745
 C   15.165514   14.380912   12.284914
 C   13.733952   15.373236   10.339983
 C   13.834270   15.075195   11.806044
 C   17.692356   14.760814   12.607721
 C   18.117868   13.319614   12.320292
 H   16.224606   16.254980   12.229480
 H   15.081213   14.349308   13.382239
 H   14.497893   15.993120    9.843772
 H   13.763560   16.050341   12.334952
 H   17.458687   15.472020   10.313575
 H   15.466575   13.001061   10.917548
 H   10.123201   16.105494   11.117392
 H    7.986148    7.603726    7.096607
 H    6.649034   13.661561    9.256648
 H   11.647316    8.533549   14.471703
 H   17.578003   14.899469   13.699627
 H   17.465488   12.611559   12.850993
 H   18.054409   13.123704   11.236621
 H    19.545598   15.217191   12.249475
 H    19.879928   12.420210   12.413760

P O C H  0
6-311G*
****
Mo     0 
S   8   1.00
 2026740.93270436            0.0002054        
 385350.13660691             0.0009909        
 153625.66721216             0.0018066        
  59074.20718888             0.0092070        
  18926.56514348             0.0353847        
   7049.14637847             0.0983889        
   2906.91027690             0.2655676        
   1178.86891419             0.6716061        
S   2   1.00
    474.86543884            -0.5665737        
    193.86208674            -0.4688159        
S   2   1.00
     30.71565223             0.8305056        
     13.28375914             0.1880982        
S   2   1.00
      5.34972340            -0.8319494        
      1.94467514            -0.1949974        
S   2   1.00
      0.97320128             0.6671042        
      0.32190830             0.3817182        
S   1   1.00
     67.20988264             1.0000000        
S   1   1.00
      0.11839548             1.0000000        
S   1   1.00
      0.05367322             1.0000000        
S   1   1.00
      0.02683661             1.0000000        
P   7   1.00
  10863.79422813             0.0005857        
   3502.46398906             0.0024984        
   1407.06428281             0.0122642        
    537.92230924             0.0560023        
    218.13351373             0.1821024        
     94.27836494             0.4002267        
     42.46633549             0.4829808        
P   2   1.00
      8.99486403            -0.5715606        
      4.14037062            -0.4727762        
P   3   1.00
      1.68330345             0.3106762        
      0.73126273             0.5837458        
      0.29053886             0.1974514        
P   1   1.00
     19.68084827             1.0000000        
P   1   1.00
      0.1304384              1.0000000        
P   1   1.00
      0.0436769              1.0000000        
P   1   1.00
      0.02183845             1.0000000        
D   6   1.00
    260.39682190             0.0100876        
     77.45152306             0.0710367        
     28.75103788             0.2439763        
     11.59423933             0.4441040        
      4.72142252             0.3954699        
      1.73212087             0.0926277        
D   1   1.00
      0.60240161             1.0000000        
D   1   1.00
      0.17860241             1.0000000        
D   1   1.00
      0.2572650              1.0000000        
F   1   1.00
      1.1248440              1.0000000        
F   1   1.00
      0.3345650              1.0000000        
G   1   1.00
      0.8460700              1.0000000        
****






