%chk=000047397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047397

0 1
 N   0.4358000       1.089100     -0.8993000    
 C   4.4300001E-02  1.0400000E-02  3.1500001E-02
 C   -1.119400      0.5461000      0.9094000    
 C    1.286500     -0.3322000      0.8906000    
 C  -0.4483000      -1.169800     -0.8477000    
 C   -2.400100      0.9152000      0.1482000    
 C    2.490600     -0.8707000      0.1060000    
 C  -0.9904000      -2.379600     -7.9300001E-02
 C   -3.498900       1.361300       1.103000    
 C    3.643700      -1.220000       1.036100    
 C   -1.532200      -3.437300      -1.030300    
 C   0.8277000       2.145000     -0.2912000    
 C    1.260600       3.342600      -1.077000    
 H  -0.8166000       1.407900       1.514600    
 H   -1.371600     -0.2181000       1.656600    
 H    1.614800      0.5102000       1.509200    
 H   0.9916000      -1.100400       1.618600    
 H   0.3631000      -1.503700      -1.506600    
 H   -1.213400     -0.8160000      -1.550700    
 H   -2.787500      6.1299998E-02 -0.4147000    
 H   -2.199600       1.719600     -0.5677000    
 H    2.220800      -1.777200     -0.4443000    
 H    2.833900     -0.1304000     -0.6245000    
 H  -0.1983000      -2.823800      0.5326000    
 H   -1.801100      -2.087800      0.5946000    
 H   -4.403400       1.621500      0.5444000    
 H   -3.753200      0.5643000       1.809100    
 H   -3.188100       2.241900       1.674300    
 H    4.491300      -1.605100      0.4605000    
 H    3.981900     -0.3382000       1.589500    
 H    3.347100      -1.987300       1.758400    
 H   -1.907400      -4.297100     -0.4664000    
 H   -2.356200      -3.039900      -1.631500    
 H  -0.7499000      -3.791800      -1.709200    
 H   0.8851000       2.282600      0.8013000    
 H   0.6266000       4.190800     -0.8064000    
 H    2.294800       3.581400     -0.8160000    
 H    1.186700       3.156900      -2.151200    


%chk=000047397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047397

0 1
N 0.392885 1.131183 -0.872121
C -0.007821 0.003212 0.062118
C -1.165422 0.480075 1.000428
C 1.198146 -0.429906 0.958742
C -0.464130 -1.140995 -0.888543
C -2.476679 0.898662 0.297710
C 2.441255 -0.961064 0.209807
C -0.969401 -2.432653 -0.209843
C -3.495092 1.503337 1.288739
C 3.629235 -1.210658 1.164181
C -1.388511 -3.502689 -1.242127
C 0.875611 2.235429 -0.389746
C 1.274768 3.381106 -1.288577
H -0.793286 1.338269 1.599422
H -1.386077 -0.325309 1.729861
H 1.501631 0.438058 1.581543
H 0.848345 -1.202673 1.672913
H 0.380276 -1.383174 -1.562266
H -1.253518 -0.737037 -1.551139
H -2.932156 0.021021 -0.200834
H -2.250210 1.629361 -0.502649
H 2.190425 -1.904490 -0.312904
H 2.736859 -0.238827 -0.575710
H -0.180911 -2.852293 0.446772
H -1.832659 -2.203104 0.446709
H -4.438155 1.778552 0.781542
H -3.741750 0.785225 2.094183
H -3.090144 2.415346 1.767315
H 4.507513 -1.605937 0.621266
H 3.937400 -0.274980 1.668771
H 3.362101 -1.941501 1.951400
H -1.751458 -4.423794 -0.749774
H -2.197653 -3.126150 -1.896254
H -0.537264 -3.778846 -1.892977
H 1.027252 2.414925 0.700282
H 0.699172 4.293890 -1.038666
H 2.344656 3.632774 -1.151679
H 1.096064 3.117356 -2.343394


