%chk=000161848.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161848

0 1
 N    2.206700     -8.5100003E-02  0.1093000    
 N   -6.357400       1.553100     -0.1523000    
 C  -0.4906000       1.063600      9.0700001E-02
 C   0.4528000       1.160000      -1.113200    
 C  -0.1223000     -0.1573000      0.9404000    
 C    1.918700       1.122400     -0.6761000    
 C    1.362500     -0.1507000       1.309700    
 C   -1.947900       1.000500     -0.3580000    
 C   -2.895700      0.9493000      0.8401000    
 C    3.622100     -0.1319000      0.4755000    
 C   -4.334700      0.9098000      0.4196000    
 C    4.508100     -0.1971000     -0.7690000    
 C   -5.089600     -0.2542000      0.1692000    
 C   -5.120000       2.005400      0.2199000    
 C    5.969700     -0.2685000     -0.4047000    
 C   -6.367900      0.1769000     -0.1915000    
 C   -4.826700      -1.637900      0.2093000    
 C   -7.400700     -0.7100000     -0.5156000    
 C    6.692900      0.9056000     -0.2585000    
 C    6.566200      -1.506700     -0.2221000    
 C   -5.850100      -2.536900     -0.1123000    
 C   -7.116600      -2.077900     -0.4689000    
 C    8.044800      0.8397000      7.8500003E-02
 C    7.918200      -1.572600      0.1149000    
 C    8.657500     -0.3994000      0.2652000    
 H  -0.3521000       1.965200      0.7034000    
 H   0.2611000       2.089100      -1.663500    
 H   0.2589000      0.3327000      -1.808900    
 H  -0.3626000      -1.082500      0.4004000    
 H  -0.6859000     -0.1731000       1.878500    
 H    2.490400       1.153800      -1.606800    
 H    2.159500       2.030100     -0.1075000    
 H    1.571800      0.6922000       1.981700    
 H    1.578300      -1.071300       1.865800    
 H   -2.109600      0.1234000     -0.9984000    
 H   -2.179200       1.879700     -0.9734000    
 H   -2.729700       1.822900       1.483400    
 H   -2.710700      6.6500001E-02   1.460300    
 H    3.897300      0.7333000       1.094100    
 H    3.810700      -1.026200       1.084300    
 H    4.394400      0.6769000      -1.417900    
 H    4.239700      -1.066300      -1.384200    
 H   -4.924100       3.065300      0.3042000    
 H   -7.149300       2.143200     -0.3674000    
 H   -3.844700      -2.012900      0.4835000    
 H   -8.386900     -0.3536000     -0.7934000    
 H    6.224800       1.875700     -0.3990000    
 H    5.998400      -2.425800     -0.3350000    
 H   -5.653000      -3.605300     -8.3600000E-02
 H   -7.896700      -2.793700     -0.7150000    
 H    8.620300       1.753100      0.1962000    
 H    8.395100      -2.537400      0.2609000    
 H    9.710000     -0.4507000      0.5279000    


%chk=000161848-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161848

0 1
N 2.261923 0.162522 0.118506
N -6.648527 1.457540 -0.057895
C -0.550676 1.122807 0.192611
C 0.371778 1.313856 -1.036985
C -0.060669 -0.110434 0.992581
C 1.858167 1.376801 -0.632673
C 1.436694 -0.000029 1.342559
C -2.035234 1.014885 -0.233597
C -3.042544 1.117420 0.947291
C 3.714129 0.114867 0.408876
C -4.482905 0.974123 0.518732
C 4.568677 -0.235419 -0.840745
C -5.153909 -0.258941 0.133382
C -5.427813 1.991894 0.390242
C 6.039038 -0.391422 -0.484215
C -6.509988 0.074834 -0.222461
C -4.742624 -1.617353 0.065753
C -7.445398 -0.898175 -0.639430
C 6.924975 0.716084 -0.533620
C 6.548630 -1.641580 -0.045477
C -5.670528 -2.593099 -0.347099
C -7.007366 -2.236996 -0.697791
C 8.280744 0.580572 -0.157256
C 7.902820 -1.783324 0.332200
C 8.774818 -0.670788 0.278589
H -0.439740 2.019690 0.844509
H 0.099725 2.242629 -1.576885
H 0.227355 0.466922 -1.736917
H -0.216023 -1.021155 0.379902
H -0.640286 -0.230730 1.928103
H 2.485824 1.463589 -1.537976
H 2.033460 2.301440 -0.017285
H 1.583142 0.860243 2.050683
H 1.770301 -0.915622 1.866220
H -2.194027 0.059081 -0.773017
H -2.268719 1.820884 -0.958638
H -2.895392 2.092985 1.451775
H -2.803478 0.338429 1.698576
H 4.087716 1.075073 0.850296
H 3.882908 -0.670131 1.170737
H 4.449615 0.554444 -1.605938
H 4.162933 -1.170489 -1.268642
H -5.321822 3.057713 0.586639
H -7.499623 1.989411 -0.222866
H -3.719346 -1.903751 0.335159
H -8.474097 -0.631244 -0.907543
H 6.549884 1.688774 -0.876751
H 5.878797 -2.510162 -0.007704
H -5.367136 -3.644636 -0.401879
H -7.705890 -3.018934 -1.016508
H 8.950961 1.446612 -0.206680
H 8.278759 -2.758476 0.662948
H 9.826187 -0.778834 0.568306


