%chk=000155747.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155747

0 1
 O    2.284700     -0.5523000     -4.0000002E-03
 N   -1.808800     -0.7622000      1.2000001E-03
 N   0.2299000      0.5227000     -1.4000000E-03
 C   -1.905100       1.650600      7.9999998E-04
 C   -1.096100      0.3669000      1.9999999E-04
 C   -1.646800       2.479200      -1.260100    
 C   -1.644500       2.479700       1.260800    
 C   -1.058500      -1.883500      7.9999998E-04
 C   0.9177000     -0.6381000     -1.8000000E-03
 C   0.3214000      -1.882500     -3.9999999E-04
 C   -1.792800      -3.182100      1.8000000E-03
 C    2.844600      0.7557000     -5.2999998E-03
 C    4.354400      0.6459000      7.4999998E-03
 H   -2.969800       1.380900      1.8000000E-03
 H  -0.6061000       2.817700      -1.315800    
 H   -2.289800       3.365600      -1.279400    
 H   -1.854500       1.892500      -2.161800    
 H   -1.850600       1.893400       2.163200    
 H   -2.287400       3.366100       1.280800    
 H  -0.6037000       2.818100       1.314500    
 H   0.9023000      -2.796500     -7.9999998E-04
 H   -1.537200      -3.763500      0.8934000    
 H   -2.876000      -3.021600      2.7000001E-03
 H   -1.538900      -3.763900     -0.8900000    
 H    2.532600       1.298800     -0.9056000    
 H    2.520000       1.307200      0.8854000    
 H    4.818800       1.636000      6.6999998E-03
 H    4.693700      9.7199999E-02  0.8923000    
 H    4.708000      8.9299999E-02 -0.8668000    


%chk=000155747-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155747

0 1
O 2.318303 -0.537444 -0.000148
N -1.824732 -0.785757 0.000692
N 0.209369 0.543174 -0.000230
C -1.981704 1.682952 -0.000259
C -1.156216 0.405590 0.000134
C -1.698553 2.514287 -1.278565
C -1.698198 2.515297 1.277315
C -1.065667 -1.939660 0.000998
C 0.938137 -0.601003 0.000096
C 0.343236 -1.888466 0.000748
C -1.817273 -3.252181 0.001621
C 2.939245 0.819851 0.000195
C 4.448413 0.599085 0.003927
H -3.038907 1.361929 0.000021
H -0.632536 2.800757 -1.317381
H -2.311427 3.434232 -1.279773
H -1.938144 1.940100 -2.191876
H -1.937442 1.941802 2.191150
H -2.311147 3.435195 1.278013
H -0.632195 2.801904 1.315554
H 0.961662 -2.788682 0.001049
H -1.563698 -3.857118 0.891762
H -2.899868 -3.054708 0.001802
H -1.564103 -3.857708 -0.888234
H 2.591412 1.367109 -0.894735
H 2.587021 1.368862 0.892279
H 4.967769 1.574905 0.003687
H 4.762383 0.037769 0.900481
H 4.766362 0.035228 -0.889624


