%chk=000176689.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176689

0 1
 N   0.9068000      0.8265000      0.7264000    
 N  -0.5913000     -0.8078000      0.2041000    
 N   0.6645000      -1.227800     -0.2075000    
 C  -0.5445000      0.5564000      0.7730000    
 C  -0.7935000      0.5595000       2.296200    
 C   0.1485000       1.649700       2.802200    
 C    1.396500       1.470900       1.941100    
 C   -1.266700       1.577500     -0.1047000    
 C    1.502200     -0.2648000      0.1147000    
 C   -1.697900      -1.639500      5.3100001E-02
 C    2.948400     -0.3749000     -0.1660000    
 C   -2.143000       2.503200      0.4690000    
 C   -1.055000       1.592300      -1.486400    
 C   -2.992200      -1.231800      0.4609000    
 C   -1.580300      -2.932300     -0.5150000    
 C   -2.802200       3.435600     -0.3321000    
 C   -1.714200       2.524700      -2.287500    
 C    3.563700      -1.627300     -0.1796000    
 C    3.700400      0.7731000     -0.4182000    
 C   -2.587800       3.446400      -1.710100    
 C   -4.100400      -2.065500      0.3103000    
 C   -2.688600      -3.765800     -0.6657000    
 C    4.929200      -1.731400     -0.4448000    
 C    5.065900      0.6688000     -0.6836000    
 C   -3.948600      -3.332300     -0.2531000    
 C    5.680100     -0.5835000     -0.6968000    
 H  -0.4889000     -0.3989000       2.739600    
 H   -1.830900      0.7268000       2.596400    
 H  -0.2773000       2.646300       2.645800    
 H   0.3678000       1.548300       3.869300    
 H    1.872600       2.430600       1.719400    
 H    2.118600      0.8286000       2.457700    
 H   -2.347000       2.531000       1.533300    
 H  -0.3772000      0.8890000      -1.961900    
 H   -3.161800     -0.2579000      0.9082000    
 H  -0.6149000      -3.306500     -0.8486000    
 H   -3.483700       4.152600      0.1166000    
 H   -1.546800       2.534000      -3.360500    
 H    2.998100      -2.533700      1.9800000E-02
 H    3.240500       1.757600     -0.4252000    
 H   -3.101200       4.172300      -2.333900    
 H   -5.081500      -1.728800      0.6323000    
 H   -2.571000      -4.752400      -1.104100    
 H    5.408000      -2.706200     -0.4539000    
 H    5.650400       1.562200     -0.8826000    
 H   -4.811500      -3.981500     -0.3702000    
 H    6.743300     -0.6646000     -0.9037000    


%chk=000176689-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176689

0 1
N 0.932925 0.852755 0.619060
N -0.583771 -0.794956 0.105633
N 0.704786 -1.282572 -0.208762
C -0.549280 0.573461 0.727688
C -0.786037 0.587188 2.272059
C 0.212886 1.650575 2.796601
C 1.423824 1.602296 1.809360
C -1.370481 1.591897 -0.089483
C 1.561717 -0.310538 0.111085
C -1.702106 -1.640341 -0.002845
C 3.007587 -0.418379 -0.117886
C -2.164490 2.599206 0.509994
C -1.282667 1.544516 -1.504299
C -2.999384 -1.198217 0.386191
C -1.544649 -2.960106 -0.518052
C -2.856869 3.540427 -0.286546
C -1.974780 2.478468 -2.301046
C 3.608467 -1.701542 -0.261530
C 3.826760 0.741160 -0.217338
C -2.765088 3.483922 -1.694543
C -4.107102 -2.060869 0.257741
C -2.663935 -3.805596 -0.639774
C 4.992102 -1.817958 -0.494376
C 5.213413 0.617531 -0.447935
C -3.954955 -3.370203 -0.253421
C 5.804089 -0.659921 -0.584281
H -0.520766 -0.415470 2.652482
H -1.825780 0.792798 2.569988
H -0.243827 2.655436 2.786681
H 0.529022 1.436193 3.831322
H 1.745058 2.622044 1.531367
H 2.291851 1.077643 2.247407
H -2.257146 2.661957 1.599498
H -0.676965 0.762168 -1.974751
H -3.150191 -0.183288 0.764084
H -0.547508 -3.293554 -0.813584
H -3.469449 4.312826 0.192241
H -1.902822 2.422560 -3.392880
H 2.973358 -2.589983 -0.188245
H 3.370755 1.734312 -0.147456
H -3.304678 4.210186 -2.312586
H -5.098223 -1.701253 0.557933
H -2.525178 -4.817036 -1.039610
H 5.442290 -2.811083 -0.602766
H 5.831630 1.518533 -0.529622
H -4.820010 -4.034619 -0.350015
H 6.881216 -0.753876 -0.761085


