%chk=000009022.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009022

1 1
 N    1.946900     -2.1800000E-02 -5.1000002E-03
 C   0.6726000     -0.7766000     -1.9200001E-02
 C  -0.5177000      0.1740000      2.8800000E-02
 C    2.003300      0.9805000      -1.167600    
 C    2.104500      0.7626000       1.306100    
 C    3.147500     -0.9705000     -0.1379000    
 C   -1.901300     -0.4850000      1.6400000E-02
 C   -3.053500      0.5199000     -1.6000000E-03
 C   -4.402300     -0.1830000     -2.0099999E-02
 H   0.6646000      -1.457200      0.8405000    
 H   0.6427000      -1.380200     -0.9343000    
 H  -0.4818000      0.7984000      0.9270000    
 H  -0.5035000      0.8499000     -0.8323000    
 H    1.330700       1.818800     -0.9700000    
 H    3.027000       1.362700      -1.236100    
 H    1.735700      0.4564000      -2.089600    
 H    3.121300       1.167000       1.339400    
 H    1.393500       1.591300       1.332500    
 H    1.944800      7.4299999E-02   2.141100    
 H    3.119000      -1.672300      0.7007000    
 H    3.056000      -1.502900      -1.089100    
 H    4.068200     -0.3803000     -0.1145000    
 H   -1.994400      -1.132700      0.8970000    
 H   -1.976100      -1.135900     -0.8637000    
 H   -2.971000       1.164800     -0.8840000    
 H   -2.995100       1.167300      0.8809000    
 H   -4.503500     -0.8146000     -0.9085000    
 H   -5.212500      0.5527000     -3.2200001E-02
 H   -4.528600     -0.8130000      0.8662000    


%chk=000009022-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000009022

1 1
N 2.022746 0.042125 -0.008156
C 0.605857 -0.606612 -0.046996
C -0.585893 0.360041 0.004927
C 2.210818 0.998296 -1.183115
C 2.233959 0.795410 1.302986
C 3.057906 -1.079100 -0.108562
C -1.913144 -0.447259 -0.014794
C -3.157957 0.470398 0.023868
C -4.476881 -0.330541 0.010452
H 0.576577 -1.303342 0.810271
H 0.579068 -1.202568 -0.977330
H -0.566245 0.975270 0.924307
H -0.581963 1.047106 -0.861974
H 1.521564 1.847259 -1.078206
H 3.249748 1.362396 -1.183306
H 2.002381 0.461221 -2.120980
H 3.265509 1.178894 1.331901
H 1.526787 1.634096 1.363455
H 2.068091 0.105457 2.144411
H 2.916710 -1.776833 0.730875
H 2.920407 -1.611941 -1.061704
H 4.068742 -0.645166 -0.066640
H -1.943546 -1.137968 0.852343
H -1.954686 -1.077553 -0.926416
H -3.133643 1.159442 -0.844095
H -3.118769 1.104948 0.932036
H -4.561923 -0.948592 -0.902318
H -5.349608 0.344594 0.039648
H -4.545612 -1.004878 0.883915


