%chk=000079671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079671

0 1
 N   -3.809800      0.3764000     -8.3999997E-03
 N   -8.736500      0.4349000      2.1199999E-02
 C    1.226000      0.3632000     -3.4100000E-02
 C    2.496200     -0.4894000      1.4800000E-02
 C    3.783500      0.3418000      4.1600000E-02
 C  -5.9999999E-02 -0.4697000     -7.3399998E-02
 C    5.091100     -0.4559000      6.8400003E-02
 C   -1.333300      0.3827000     -4.1800000E-02
 C    6.342500      0.4237000      3.7599999E-02
 C   -2.613100     -0.4563000     -2.0600000E-02
 C    7.613600     -0.4244000     -2.4700001E-02
 C   -5.013100     -0.4437000      1.5000000E-03
 C   -6.285500      0.4065000      5.7000001E-03
 C    8.862400      0.4431000     -2.2900000E-02
 C   -7.564000     -0.4330000      3.5000000E-02
 H    1.203200       1.020100      0.8442000    
 H    1.258600       1.014400     -0.9161000    
 H    2.467800      -1.132800      0.9026000    
 H    2.518200      -1.153800     -0.8575000    
 H  -6.1099999E-02  -1.091400     -0.9770000    
 H  -6.7900002E-02  -1.154900      0.7833000    
 H    3.758200       1.002600      0.9174000    
 H    3.792200      0.9969000     -0.8390000    
 H    5.105500      -1.134900     -0.7932000    
 H    5.108900      -1.085100      0.9668000    
 H   -1.342500       1.044000     -0.9176000    
 H   -1.309300       1.030000      0.8443000    
 H    6.362400       1.060900      0.9299000    
 H    6.303400       1.088400     -0.8339000    
 H   -2.621200      -1.103700     -0.9060000    
 H   -2.597800      -1.105100      0.8640000    
 H    7.649000      -1.105600      0.8334000    
 H    7.605400      -1.042500     -0.9299000    
 H   -3.798700      0.9852000      0.8092000    
 H   -5.017700      -1.092100      0.8865000    
 H   -5.028900      -1.091800     -0.8833000    
 H   -6.270200       1.074200      0.8775000    
 H   -6.291600       1.049400     -0.8847000    
 H    8.917600       1.049600      0.8867000    
 H    9.758900     -0.1831000     -6.8599999E-02
 H    8.873600       1.116100     -0.8862000    
 H   -7.598100      -1.095400     -0.8363000    
 H   -7.584100      -1.059700      0.9333000    
 H   -9.578700     -0.1345000      9.2299998E-02
 H   -8.728100       1.036400      0.8441000    


%chk=000079671-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079671

0 1
N -3.842662 0.231445 0.012117
N -8.801100 0.608884 0.042792
C 1.227726 0.328079 0.006336
C 2.536867 -0.493118 0.005983
C 3.809215 0.383936 -0.000191
C -0.044852 -0.548589 0.014431
C 5.119471 -0.435723 -0.001452
C -1.350569 0.277330 0.008856
C 6.391371 0.442149 -0.007658
C -2.618413 -0.598515 0.018431
C 7.702208 -0.377545 -0.009684
C -5.109827 -0.530875 0.016336
C -6.326180 0.414774 0.016149
C 8.967052 0.508257 -0.015404
C -7.670035 -0.341517 0.034209
H 1.216460 0.998455 0.891382
H 1.210101 0.990264 -0.884355
H 2.553545 -1.156748 0.896051
H 2.549033 -1.162353 -0.879842
H -0.031632 -1.219315 -0.870142
H -0.027695 -1.209771 0.906255
H 3.797092 1.053173 0.885705
H 3.791968 1.047798 -0.889951
H 5.132038 -1.104794 -0.887471
H 5.137078 -1.099602 0.888428
H -1.382794 0.933687 -0.882412
H -1.360920 0.947768 0.895326
H 6.380634 1.111000 0.878569
H 6.375050 1.106411 -0.897216
H -2.632533 -1.232990 -0.890998
H -2.574882 -1.299932 0.892998
H 7.717303 -1.041290 0.879039
H 7.712083 -1.045158 -0.895549
H -3.824443 0.924259 0.775398
H -5.186205 -1.236084 0.886009
H -5.132374 -1.158446 -0.897805
H -6.272907 1.079066 0.907190
H -6.289142 1.068459 -0.873254
H 8.994952 1.163685 0.875696
H 9.890130 -0.100437 -0.016525
H 8.989947 1.159286 -0.909854
H -7.748390 -0.955844 -0.883964
H -7.669781 -1.053550 0.897972
H -9.720166 0.178318 -0.096946
H -8.796822 1.247415 0.845115


