%chk=000146618.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146618

0 1
 O   -2.168700       1.379500     -0.8964000    
 O   0.3674000      -2.106000      -1.250100    
 N   -1.146000      -1.041300      0.1086000    
 N  -0.1235000       1.842400      0.1880000    
 C   -1.551400      6.2000002E-03   1.036700    
 C   -2.972000     -0.3978000       1.456500    
 C   -3.488400      -1.235200      0.2947000    
 C   -2.241500      -1.957200     -0.1807000    
 C   -1.480600       1.366900      0.3490000    
 C   0.1029000      -1.201400     -0.4562000    
 C    1.195600     -0.2619000     -8.1100002E-02
 C    1.053000       1.120100      0.1436000    
 C    2.477600     -0.8545000     -4.1499998E-02
 C    2.236800       1.854500      0.3989000    
 C    3.618400     -0.1006000      0.2191000    
 C   -2.091500       2.653300      -1.520500    
 C    3.498600       1.260700      0.4365000    
 C    2.713400      -2.327700     -0.2051000    
 H  -0.8918000     -1.1600000E-02   1.913300    
 H   -3.620300      0.4525000       1.687700    
 H   -2.918900      -1.028200       2.353400    
 H   -4.285900      -1.923700      0.5878000    
 H   -3.877900     -0.5851000     -0.4966000    
 H   -2.065700      -2.873500      0.3938000    
 H   -2.272300      -2.209800      -1.244700    
 H   -1.988400       2.084200       1.007700    
 H  -1.8100001E-02   2.853000      0.2071000    
 H    2.176800       2.926800      0.5854000    
 H    4.604500     -0.5553000      0.2578000    
 H   -2.375400       3.455600     -0.8318000    
 H   -2.798000       2.658900      -2.355800    
 H   -1.094400       2.832100      -1.934000    
 H    4.378200       1.863400      0.6407000    
 H    1.992000      -2.920700      0.3671000    
 H    2.703800      -2.612300      -1.261900    
 H    3.695000      -2.620400      0.1881000    


%chk=000146618-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146618

0 1
O -2.220991 1.283686 -0.859884
O 0.250997 -2.047623 -1.408060
N -1.128736 -1.037368 0.130677
N -0.078964 1.865097 0.219129
C -1.501703 0.025540 1.083606
C -2.919262 -0.396117 1.547470
C -3.512124 -1.172732 0.341482
C -2.287931 -1.855498 -0.313258
C -1.445156 1.412154 0.394611
C 0.095535 -1.166521 -0.495299
C 1.241892 -0.290115 -0.041903
C 1.124705 1.119386 0.208555
C 2.543191 -0.900819 0.026192
C 2.301429 1.887092 0.462475
C 3.680858 -0.111104 0.305529
C -2.250877 2.517240 -1.647975
C 3.564195 1.283112 0.500649
C 2.752428 -2.391259 -0.186613
H -0.791921 0.057241 1.932664
H -3.536103 0.470491 1.840836
H -2.826201 -1.060990 2.426000
H -4.276518 -1.905737 0.650819
H -3.961889 -0.462301 -0.369548
H -2.149482 -2.900751 0.024130
H -2.332926 -1.866079 -1.415164
H -1.962049 2.172403 1.025459
H 0.062412 2.872370 0.301234
H 2.204067 2.965853 0.643652
H 4.662628 -0.592822 0.364450
H -2.665589 3.367505 -1.062505
H -2.909900 2.309743 -2.505087
H -1.241646 2.782979 -2.018086
H 4.453891 1.890366 0.701124
H 2.003923 -2.998492 0.351729
H 2.641542 -2.654825 -1.251762
H 3.759576 -2.685203 0.157774


