%chk=000119555.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119555

0 1
 O   0.4129000      -1.398600       1.437000    
 O    3.757600      -1.846200     -0.1542000    
 O    1.909800      -1.692700      -1.329500    
 N   -2.811100      9.2100002E-02  0.3974000    
 N    1.470400      0.8343000     -4.9400002E-02
 N    3.666000      0.9578000      7.5599998E-02
 N    2.775400      -1.167300     -0.5716000    
 C   -4.136600     -0.4906000      0.2438000    
 C   -3.312300     -0.1175000     -0.9536000    
 C   -1.848800     -0.9222000      0.8065000    
 C   -5.303400      0.3475000      0.6102000    
 C   -3.741400       1.012500      -1.813700    
 C  -0.4488000     -0.3367000       1.020700    
 C   0.1324000      0.2788000     -0.2583000    
 C    2.645400      0.1735000     -0.1919000    
 C    1.730200       2.109400      0.3292000    
 C    3.102300       2.165800      0.4017000    
 H   -4.287200      -1.542900      0.4490000    
 H   -2.902600     -0.9277000      -1.546100    
 H   -1.781500      -1.775500      0.1159000    
 H   -2.169900      -1.360700       1.762100    
 H   -5.076200       1.417700      0.6573000    
 H   -6.120600      0.1981000     -0.1029000    
 H   -5.671700      5.3900000E-02   1.599100    
 H   -2.963700       1.227900      -2.554300    
 H   -4.656000      0.7565000      -2.357900    
 H   -3.915700       1.936600      -1.253700    
 H  -0.4656000      0.4036000       1.829100    
 H  -0.4882000       1.126600     -0.5766000    
 H   0.1343000     -0.4098000      -1.102000    
 H   0.4110000      -2.077200      0.7404000    
 H   0.9596000       2.845100      0.5126000    
 H    3.712700       3.014800      0.6728000    


%chk=000119555-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000119555

0 1
O 0.434563 -1.374826 1.685831
O 3.961958 -1.529572 -1.188154
O 1.771434 -1.991382 -0.730551
N -2.863224 -0.001435 0.438119
N 1.370086 0.779393 -0.086051
N 3.649375 1.017833 -0.059447
N 2.806413 -1.178118 -0.763566
C -4.256922 -0.502064 0.125439
C -3.310899 -0.124687 -1.011229
C -1.899216 -1.018857 0.943398
C -5.432070 0.343158 0.581460
C -3.435596 1.141978 -1.837881
C -0.497484 -0.394012 1.137176
C -0.000738 0.226137 -0.194162
C 2.618619 0.175148 -0.300834
C 1.652441 2.071326 0.334110
C 3.055656 2.200080 0.345042
H -4.404672 -1.587733 0.251669
H -2.890889 -0.985976 -1.558713
H -1.814697 -1.912459 0.277273
H -2.240083 -1.371927 1.933343
H -5.227789 1.418985 0.453097
H -6.344820 0.087877 0.011211
H -5.638754 0.167419 1.653060
H -2.455227 1.441023 -2.255557
H -4.126286 0.986082 -2.687451
H -3.814902 1.980911 -1.231478
H -0.563988 0.398678 1.903630
H -0.678251 1.050212 -0.469941
H -0.006949 -0.531946 -0.993788
H 0.790193 -1.936557 0.941283
H 0.860522 2.775283 0.578024
H 3.650896 3.066925 0.620335


