%chk=000155870.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155870

0 1
 O    2.632900      -1.623100       1.388500    
 N   -2.519500      3.4000002E-02 -0.2520000    
 N    2.652100      0.4195000      0.2184000    
 C   -2.274700      -1.058900      0.6886000    
 C   -3.953200     -2.2900000E-02 -0.5353000    
 C   -3.109300      -2.195200      0.1164000    
 C   -4.210400      -1.514500     -0.6910000    
 C   -2.108800       1.325800      0.2780000    
 C    3.056000      0.8765000      -1.090200    
 C    4.047100     -0.1811000      -1.533100    
 C    3.559700      -1.450500     -0.8449000    
 C   -2.450000       2.439300     -0.7036000    
 C    2.908400     -0.9352000      0.4171000    
 C    1.937200       1.281100       1.134800    
 C  -0.6714000       1.309900      0.5798000    
 C   0.5039000       1.295400      0.8287000    
 H   -2.628600     -0.8176000       1.699500    
 H   -1.220800      -1.350000      0.7461000    
 H   -4.230000      0.5057000      -1.452800    
 H   -4.552700      0.3701000      0.2960000    
 H   -3.520800      -2.829300      0.9083000    
 H   -2.505200      -2.829600     -0.5428000    
 H   -4.138000      -1.815300      -1.742800    
 H   -5.206600      -1.790100     -0.3306000    
 H   -2.643800       1.538700       1.214400    
 H    3.511600       1.869100      -1.033300    
 H    2.174100      0.9047000      -1.738400    
 H    5.048900      7.1300000E-02  -1.163200    
 H    4.106000     -0.2804000      -2.620500    
 H    4.383400      -2.129700     -0.6126000    
 H    2.803700      -1.966200      -1.445200    
 H   -3.529900       2.584000     -0.8117000    
 H   -2.027000       2.247500      -1.697200    
 H   -2.037300       3.396000     -0.3608000    
 H    2.085400      0.8988000       2.150700    
 H    2.369200       2.285500       1.085100    


%chk=000155870-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155870

0 1
O 3.382257 -1.366985 1.740617
N -2.602179 0.043237 -0.283205
N 2.765923 0.400834 0.304369
C -2.398870 -1.115755 0.631918
C -4.062768 0.038829 -0.591490
C -3.226813 -2.227580 -0.044468
C -4.448590 -1.469339 -0.658749
C -2.101952 1.344180 0.245143
C 2.814341 0.762290 -1.125944
C 3.945213 -0.154183 -1.679469
C 3.977206 -1.358930 -0.703353
C -2.319949 2.486443 -0.781347
C 3.370135 -0.819640 0.601304
C 1.952869 1.126138 1.291957
C -0.670004 1.247774 0.611559
C 0.520681 1.196152 0.930632
H -2.793309 -0.904067 1.659796
H -1.327153 -1.355755 0.722280
H -4.264719 0.568401 -1.538072
H -4.647877 0.549092 0.217510
H -3.526587 -3.012898 0.670770
H -2.629292 -2.699830 -0.842967
H -4.631470 -1.793191 -1.697370
H -5.373589 -1.657659 -0.085776
H -2.665132 1.614666 1.182148
H 3.040819 1.837298 -1.251385
H 1.836807 0.561968 -1.609022
H 4.909121 0.383115 -1.645916
H 3.755865 -0.449636 -2.724320
H 4.986903 -1.759117 -0.518338
H 3.347066 -2.198757 -1.052539
H -3.395490 2.654533 -0.963019
H -1.833709 2.227567 -1.737387
H -1.883975 3.426319 -0.401785
H 2.088704 0.585170 2.249249
H 2.351118 2.152618 1.425074


