%chk=000040879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040879

0 1
 N   -2.355100     -0.9020000      0.6263000    
 C  -0.6577000     -0.1825000     -0.9873000    
 C   -2.101300     -0.7548000     -0.8219000    
 C  -0.5337000       1.194900     -0.2973000    
 C   -2.587300      0.4850000       1.061700    
 C   -1.203800       1.179700       1.093600    
 C   -3.176100      0.2415000      -1.279600    
 C   -3.501200       1.063200     -2.6100000E-02
 C   0.3801000      -1.198200     -0.4597000    
 C   0.8983000       1.741800     -0.2836000    
 C    1.757100     -0.6455000     -0.2162000    
 C    1.987100      0.7283000     -7.3399998E-02
 C   -3.470900      -1.794700      0.9253000    
 C    2.825300      -1.543100     -5.0500002E-02
 C    3.287500       1.183200      0.2021000    
 C    4.110100      -1.080900      0.2304000    
 C    4.341700      0.2840000      0.3561000    
 H  -0.4629000     -3.2099999E-02  -2.058800    
 H   -2.173800      -1.706300      -1.362000    
 H   -1.101200       1.921600     -0.8954000    
 H   -3.039600      0.5480000       2.057800    
 H  -0.5561000      0.6713000       1.819600    
 H   -1.324800       2.211000       1.448200    
 H   -4.077300     -0.2880000      -1.611300    
 H   -2.844800      0.8727000      -2.110400    
 H   -3.346700       2.135100     -0.1860000    
 H   -4.555800      0.9213000      0.2390000    
 H   0.4429000      -2.023800      -1.180700    
 H   5.3100001E-02  -1.636300      0.4910000    
 H   0.9793000       2.536200      0.4689000    
 H    1.091200       2.209200      -1.259100    
 H   -3.617500      -1.861300       2.009000    
 H   -3.242800      -2.808100      0.5773000    
 H   -4.420200      -1.488800      0.4744000    
 H    2.656800      -2.614100     -0.1365000    
 H    3.485000       2.248700      0.2947000    
 H    4.926900      -1.785900      0.3531000    
 H    5.341200      0.6497000      0.5717000    


%chk=000040879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040879

0 1
N -2.313037 -0.947936 0.608225
C -0.679412 -0.172383 -1.080087
C -2.120429 -0.731433 -0.863430
C -0.552030 1.212582 -0.377724
C -2.498381 0.458168 1.093880
C -1.108385 1.148309 1.070400
C -3.230873 0.307256 -1.262665
C -3.493234 1.106760 0.060160
C 0.359131 -1.200003 -0.564782
C 0.890446 1.761024 -0.467720
C 1.739481 -0.645536 -0.237651
C 1.978736 0.751065 -0.123805
C -3.431080 -1.857903 0.943691
C 2.805433 -1.546903 0.020224
C 3.266426 1.205955 0.259667
C 4.086234 -1.087740 0.391186
C 4.318671 0.302629 0.517106
H -0.527810 -0.015636 -2.168866
H -2.229048 -1.693182 -1.398335
H -1.191814 1.924773 -0.938460
H -2.902095 0.449125 2.122075
H -0.422522 0.578904 1.725348
H -1.189503 2.174198 1.482378
H -4.144755 -0.214870 -1.598113
H -2.903977 0.960209 -2.092022
H -3.311928 2.189967 -0.058198
H -4.538129 0.982986 0.397185
H 0.456432 -2.024450 -1.300015
H -0.066942 -1.650975 0.354848
H 0.991352 2.655232 0.179503
H 1.064427 2.116084 -1.506260
H -3.508052 -1.946372 2.042322
H -3.215012 -2.862684 0.538119
H -4.428341 -1.538841 0.554958
H 2.620099 -2.625440 -0.067922
H 3.442999 2.285687 0.352606
H 4.893597 -1.803432 0.584225
H 5.306326 0.674804 0.812347


