%chk=000117060.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117060

0 1
 O   -7.128700      0.3988000      0.4353000    
 N   -1.699100      2.4900001E-02 -0.6479000    
 C    4.765000     -0.8062000     -0.1672000    
 C    5.481600      0.5243000      7.3100001E-02
 C    6.993000      0.3792000     -0.1040000    
 C    3.270300     -0.6671000     -3.0099999E-02
 C    2.679200     -0.8612000       1.209500    
 C    2.510100     -0.3463000      -1.144800    
 C    7.707400       1.706700      9.3599997E-02
 C   0.5202000     -0.4093000      0.2239000    
 C    1.296200     -0.7316000       1.337200    
 C    1.127100     -0.2165000      -1.017100    
 C  -0.9220000     -0.2757000      0.3562000    
 C   -3.074100      0.1195000     -0.3737000    
 C   -3.618800       1.340600      1.1500000E-02
 C   -3.880800      -1.008200     -0.4897000    
 C   -4.983700       1.434700      0.2834000    
 C   -5.245700     -0.9140000     -0.2179000    
 C   -5.797100      0.3074000      0.1687000    
 H    5.130500      -1.564100      0.5377000    
 H    5.005800      -1.189700      -1.167200    
 H    5.263000      0.8902000       1.084400    
 H    5.103100       1.282000     -0.6249000    
 H    7.383200     -0.3515000      0.6140000    
 H    7.215900     -8.9999998E-04  -1.107800    
 H    3.275300      -1.110600       2.082800    
 H    2.973900     -0.1923000      -2.115000    
 H    7.530000       2.101500       1.099200    
 H    7.363400       2.449500     -0.6332000    
 H    8.786600       1.579200     -3.5900000E-02
 H   0.8377000     -0.8845000       2.310800    
 H   0.5480000      3.5599999E-02  -1.901500    
 H   -1.348400     -0.4425000       1.363700    
 H   -2.992400       2.223900      0.1026000    
 H   -3.459500      -1.963600     -0.7909000    
 H   -5.401100       2.392100      0.5838000    
 H   -5.874200      -1.795700     -0.3088000    
 H   -7.337300       1.314700      0.6878000    


%chk=000117060-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117060

0 1
O -7.348230 0.428795 0.370651
N -1.730602 0.213113 -0.327164
C 4.855819 -0.755666 -0.471848
C 5.586169 0.497161 0.091396
C 7.112581 0.454147 -0.144923
C 3.353283 -0.705101 -0.249097
C 2.758391 -1.320427 0.882724
C 2.507814 0.002161 -1.150272
C 7.838685 1.697966 0.411377
C 0.531016 -0.522336 0.207416
C 1.369915 -1.231082 1.110235
C 1.122584 0.094369 -0.931953
C -0.915072 -0.445359 0.463056
C -3.133856 0.229464 -0.112436
C -3.850692 1.347995 -0.617788
C -3.870799 -0.818076 0.520418
C -5.245830 1.450420 -0.458997
C -5.266199 -0.732777 0.666623
C -5.954168 0.407433 0.187770
H 5.281634 -1.658567 0.008150
H 5.077470 -0.832503 -1.555049
H 5.378438 0.581933 1.177104
H 5.162433 1.407693 -0.378424
H 7.529215 -0.460635 0.324391
H 7.310615 0.362927 -1.232604
H 3.390779 -1.875365 1.586631
H 2.950802 0.477889 -2.034372
H 7.679612 1.795221 1.501896
H 7.462775 2.622916 -0.065154
H 8.928237 1.644286 0.232006
H 0.926618 -1.714942 1.990305
H 0.467556 0.633028 -1.624293
H -1.264712 -0.961912 1.383582
H -3.284216 2.134039 -1.126444
H -3.353462 -1.719918 0.867220
H -5.779117 2.329189 -0.844501
H -5.841417 -1.537342 1.134477
H -7.740469 1.253165 -0.010510


