%chk=000092114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092114

0 1
 O    4.994600     -0.7288000     -6.7900002E-02
 O   -4.837600      -1.379300      6.0199998E-02
 O    3.789000      -3.230100     -1.4300000E-02
 O   -3.311900      -3.700400      5.6000002E-02
 N  -0.8518000       3.784300      0.3911000    
 C   0.3048000       3.891600     -0.4883000    
 C   0.7998000       5.299900     -0.1943000    
 C    1.284600       2.779900     -0.1427000    
 C   -1.583000       5.036700      0.2245000    
 C  -0.4712000       6.080100      0.1450000    
 C   -1.627900       2.591700      6.6500001E-02
 C   0.6251000       1.403900     -7.1199998E-02
 C  -0.7875000       1.312500      2.1199999E-02
 C    1.425100      0.2307000     -5.3800002E-02
 C   -1.426000      4.3099999E-02  2.6000001E-02
 C   0.7985000      -1.044000     -1.5100000E-02
 C  -0.6366000      -1.138500      1.1100000E-02
 C    2.842500      0.2898000     -6.6600002E-02
 C   -2.838800     -8.5699998E-02  3.7599999E-02
 C    1.648000      -2.184200     -6.3000000E-03
 C   -1.328000      -2.380800      2.5000000E-02
 C    3.639300     -0.8517000     -5.4800000E-02
 C   -3.478000      -1.322400      4.8200000E-02
 C    3.039700      -2.093500     -2.6900001E-02
 C   -2.719400      -2.474500      4.4799998E-02
 C    5.651500     -0.6466000       1.196100    
 C   -5.497800      -1.410200      -1.204400    
 C    4.133600      -3.794200      -1.278500    
 C   -3.580700      -4.279500       1.331800    
 H   4.6000001E-03   3.822900      -1.544700    
 H    1.323700       5.734600      -1.051700    
 H    1.484200       5.323200      0.6624000    
 H    1.760900       2.973500      0.8273000    
 H    2.062300       2.784200     -0.9154000    
 H   -2.260800       5.230700       1.061500    
 H   -2.165400       5.051000     -0.7054000    
 H  -0.3469000       6.599300       1.102000    
 H  -0.6932000       6.831700     -0.6199000    
 H   -2.128500       2.698700     -0.9050000    
 H   -2.389800       2.492100      0.8476000    
 H    3.358100       1.248300     -7.8000002E-02
 H   -3.476800      0.7960000      3.0400001E-02
 H    1.234400      -3.189200      2.2600001E-02
 H  -0.7852000      -3.322800      1.5699999E-02
 H    6.726700     -0.5576000       1.017900    
 H    5.467700      -1.550700       1.785100    
 H    5.313300      0.2367000       1.747000    
 H   -5.278000     -0.5014000      -1.773600    
 H   -6.575500      -1.460100      -1.026900    
 H   -5.195500      -2.293900      -1.775100    
 H    3.231800      -4.078600      -1.829900    
 H    4.733000      -4.691400      -1.101200    
 H    4.727100      -3.087300      -1.866900    
 H   -4.056000      -5.251400       1.173400    
 H   -4.263300      -3.645400       1.906500    
 H   -2.650100      -4.430900       1.887700    


%chk=000092114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092114

0 1
O 5.064658 -0.633371 -0.070109
O -4.917515 -1.284441 0.077814
O 3.801657 -3.276665 -0.096242
O -3.320486 -3.740709 0.133259
N -0.876277 3.854930 0.346517
C 0.324594 3.967579 -0.513514
C 0.807924 5.416836 -0.256621
C 1.302369 2.845366 -0.145830
C -1.606743 5.132855 0.206497
C -0.474533 6.197932 0.195963
C -1.653347 2.639258 0.084497
C 0.612238 1.485713 -0.066103
C -0.775898 1.392014 0.015260
C 1.428834 0.277227 -0.064278
C -1.431144 0.090434 0.028571
C 0.809462 -1.024887 -0.032321
C -0.647480 -1.119963 0.010095
C 2.856355 0.354043 -0.064930
C -2.857155 -0.018532 0.039040
C 1.645792 -2.179845 -0.059320
C -1.326515 -2.373196 0.058597
C 3.658226 -0.790461 -0.056496
C -3.502819 -1.257765 0.052720
C 3.039758 -2.083549 -0.090035
C -2.720682 -2.458808 0.098994
C 5.755475 -1.180837 1.121986
C -5.540908 -1.944193 -1.094454
C 4.626886 -3.469890 -1.312419
C -4.104786 -4.015468 1.361076
H 0.040077 3.857147 -1.595108
H 1.269152 5.853934 -1.159335
H 1.567026 5.422903 0.545845
H 1.768104 3.083313 0.832440
H 2.118039 2.812337 -0.893967
H -2.324398 5.271378 1.035303
H -2.183530 5.171824 -0.754834
H -0.329719 6.618196 1.205560
H -0.717689 7.033220 -0.483574
H -2.236835 2.723058 -0.875381
H -2.399809 2.519580 0.893758
H 3.368561 1.319051 -0.044315
H -3.493283 0.869999 0.014918
H 1.224015 -3.188223 -0.073068
H -0.776560 -3.317326 0.085587
H 6.829616 -1.034826 0.931137
H 5.526023 -2.253455 1.253653
H 5.453029 -0.617837 2.025396
H -5.324601 -1.365684 -2.012716
H -6.623050 -1.937370 -0.893369
H -5.172432 -2.979523 -1.207516
H 3.974065 -3.581305 -2.198978
H 5.188517 -4.400895 -1.141076
H 5.318153 -2.620651 -1.459805
H -4.544511 -5.013306 1.211106
H -4.897409 -3.258440 1.501102
H -3.435791 -4.026705 2.242425


