%chk=000092535.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092535

0 1
 O    3.136400     -0.1246000      -2.240400    
 O   -2.346900     -0.6750000      0.6872000    
 O   -1.549000       2.329900     -0.7170000    
 N    5.350800     -0.2109000     -0.4041000    
 C    6.235300      0.4044000      0.5909000    
 C    3.968900     -0.1636000      4.2300001E-02
 C    3.039100     -0.8094000     -0.9923000    
 C    7.675200      0.3397000      7.0900001E-02
 C    5.811200       1.864100      0.7845000    
 C    6.118800     -0.3582000       1.916000    
 C    1.595200     -0.7683000     -0.5417000    
 C    1.010200      0.4535000     -0.2574000    
 C   0.8907000      -1.953700     -0.4237000    
 C  -0.3208000      0.4910000      0.1581000    
 C   -1.046100     -0.6938000      0.2826000    
 C  -0.4404000      -1.916200     -8.3999997E-03
 C  -0.9537000       1.808100      0.4639000    
 C   -3.313800      -1.210600     -0.2142000    
 C   -4.610700     -0.4782000     -3.3199999E-02
 C   -5.542500     -0.9448000      0.8873000    
 C   -4.869500      0.6605000     -0.7880000    
 C   -6.748400     -0.2641000       1.055200    
 C   -6.075300       1.341300     -0.6201000    
 C   -7.014700      0.8790000      0.3015000    
 H    3.650400      0.8735000      0.1666000    
 H    3.811500     -0.6937000      0.9869000    
 H    5.627400      -1.179400     -0.5643000    
 H    3.347400      -1.847700      -1.169100    
 H    7.778300      0.8682000     -0.8841000    
 H    8.373500      0.7997000      0.7795000    
 H    7.998200     -0.6965000     -8.4500000E-02
 H    4.896600       1.982500       1.375100    
 H    5.679300       2.380600     -0.1739000    
 H    6.588500       2.412100       1.332200    
 H    6.222800      -1.440300       1.772600    
 H    6.920900     -5.1399998E-02   2.599000    
 H    5.183200     -0.1672000       2.451700    
 H    1.561500       1.382500     -0.3716000    
 H    1.351700      -2.911800     -0.6454000    
 H  -0.9901000      -2.848100      9.2000000E-02
 H    4.074200     -0.1227000      -2.497900    
 H  -0.2081000       2.524900      0.8265000    
 H   -1.720000       1.719600       1.241400    
 H   -2.982200      -1.121400      -1.257900    
 H   -3.446400      -2.279200     -4.6000001E-03
 H   -1.954900       3.181100     -0.4797000    
 H   -5.344500      -1.832800       1.481100    
 H   -4.144700       1.029900      -1.508100    
 H   -7.479800     -0.6237000       1.773200    
 H   -6.282600       2.231600      -1.206700    
 H   -7.953500       1.409200      0.4324000    


%chk=000092535-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092535

0 1
O 3.518407 0.679567 -1.846470
O -2.391526 -0.013338 0.546592
O -1.956091 2.457737 -1.297499
N 5.413056 -0.393640 -0.304835
C 6.394769 0.181000 0.681076
C 4.017143 -0.655630 0.128882
C 3.090856 -0.515031 -1.126892
C 7.763370 0.214993 -0.042393
C 5.970851 1.625058 1.046167
C 6.502211 -0.687584 1.967320
C 1.626162 -0.411654 -0.735474
C 0.989308 0.849423 -0.635137
C 0.883478 -1.572793 -0.423741
C -0.353202 0.971069 -0.221886
C -1.073999 -0.213014 0.109323
C -0.460070 -1.482935 0.004706
C -1.031077 2.316712 -0.138840
C -3.336554 -1.141002 0.478558
C -4.735504 -0.566135 0.366365
C -5.822667 -1.186892 1.026527
C -4.967179 0.572602 -0.446788
C -7.135626 -0.686465 0.867633
C -6.278422 1.074437 -0.598357
C -7.366540 0.445720 0.053403
H 3.722624 0.119241 0.856966
H 3.866084 -1.646494 0.607700
H 5.819873 -1.218757 -0.770852
H 3.235355 -1.416349 -1.767789
H 7.702238 0.828953 -0.958500
H 8.540374 0.642210 0.615637
H 8.088389 -0.804550 -0.328793
H 5.012633 1.651383 1.595581
H 5.858705 2.236086 0.133272
H 6.736211 2.091615 1.692370
H 6.836315 -1.713847 1.722822
H 7.229637 -0.251454 2.676666
H 5.527354 -0.756073 2.483675
H 1.559485 1.737839 -0.925817
H 1.349030 -2.562356 -0.517862
H -1.009504 -2.393993 0.261608
H 4.508803 0.711589 -1.639390
H -0.266509 3.119563 -0.172198
H -1.607314 2.393794 0.805051
H -3.096362 -1.753126 -0.416363
H -3.235847 -1.780374 1.378872
H -2.511449 3.266447 -1.149189
H -5.646635 -2.059843 1.668112
H -4.111850 1.057667 -0.933201
H -7.972033 -1.173090 1.382080
H -6.455134 1.954311 -1.227925
H -8.383024 0.837003 -0.068475


