%chk=000116925.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116925

0 1
 O    2.929700      -1.983300      0.7286000    
 O   0.2972000       3.695000      0.4654000    
 O   0.7444000      -1.771900      -1.250500    
 N    1.360600      0.2126000     -0.1798000    
 N   -3.641200     -0.3038000      0.4248000    
 C    2.772400      6.8499997E-02 -0.5057000    
 C    1.006400       1.405700      0.5860000    
 C   0.4553000     -0.7652000     -0.6049000    
 C    3.517800     -0.6986000      0.5710000    
 C   0.6677000       2.572200     -0.3240000    
 C  -0.9634000     -0.6056000     -0.2483000    
 C   -1.805700      8.2800001E-02  -1.100200    
 C   -1.432900      -1.146200      0.9334000    
 C   -3.132200      0.2057000     -0.7193000    
 C   -2.776000     -0.9681000       1.223400    
 H    3.217700       1.057400     -0.6583000    
 H    2.851300     -0.4762000      -1.453900    
 H    1.832400       1.668800       1.257700    
 H   0.1551000       1.197000       1.241500    
 H    3.465100     -0.1851000       1.535700    
 H    4.571700     -0.8249000      0.3051000    
 H  -0.1599000       2.339700     -0.9977000    
 H    1.531500       2.852000     -0.9360000    
 H   -1.458400      0.5076000      -2.035300    
 H  -0.7870000      -1.688900       1.614500    
 H    3.004000      -2.446400     -0.1233000    
 H   9.5200002E-02   4.421500     -0.1487000    
 H   -3.843400      0.7332000      -1.346200    
 H   -3.204800      -1.368400       2.136200    


%chk=000116925-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116925

0 1
O 3.579089 -2.147193 0.244759
O 0.618101 3.965416 0.089821
O 0.934648 -1.986091 -0.355053
N 1.303027 0.302032 -0.173698
N -3.848604 -0.589852 0.414056
C 2.745464 0.095681 -0.508027
C 0.940729 1.626572 0.380702
C 0.470507 -0.804171 -0.173188
C 3.559555 -0.722500 0.533686
C 0.926518 2.750343 -0.672022
C -1.014157 -0.647434 0.044890
C -1.815893 0.325637 -0.602054
C -1.665667 -1.606313 0.860976
C -3.213650 0.310756 -0.392819
C -3.065558 -1.531045 1.024781
H 3.183989 1.102638 -0.618574
H 2.820224 -0.422814 -1.481712
H 1.675087 1.900496 1.162615
H -0.046185 1.577899 0.865045
H 3.166008 -0.507222 1.553448
H 4.615160 -0.398488 0.499369
H 0.157986 2.549440 -1.447448
H 1.913449 2.831224 -1.175166
H -1.379290 1.064641 -1.280349
H -1.084079 -2.398741 1.340512
H 2.638530 -2.398353 -0.002819
H 0.609371 4.750394 -0.512169
H -3.859564 1.043819 -0.888705
H -3.594194 -2.249668 1.660342


