%chk=000034536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034536

0 1
 I   -1.263400      -2.475600       1.085200    
 I  -0.9359000       3.506800     -9.2299998E-02
 I    4.143800      0.1187000     -4.8000000E-02
 O   -2.678300      0.8420000       1.724600    
 O   -4.631400      -1.706800      -1.332400    
 O    2.332800       2.883800      -1.646700    
 O    2.698800       3.463000      0.5206000    
 O    1.891200      -3.002900      -1.537600    
 N   -2.953600      0.4401000     -0.5424000    
 N    1.904000      -2.093900      0.6358000    
 C  -0.7360000      0.4892000      0.4590000    
 C    1.274100     -0.8509000      0.4759000    
 C  -0.1095000     -0.7467000      0.6193000    
 C    1.404400       1.516300      1.1600000E-02
 C   2.0900000E-02   1.620700      0.1552000    
 C    2.031000      0.2805000      0.1720000    
 C   -2.187600      0.5988000      0.6131000    
 C   -4.395000      0.5436000     -0.5572000    
 C   -5.033200     -0.8126000     -0.3029000    
 C    2.199200       2.703500     -0.3077000    
 C    2.162500      -3.056700     -0.3425000    
 C    2.861200      -4.260900      0.2373000    
 H   -4.670600      0.9172000      -1.548700    
 H   -4.718600       1.266500      0.1982000    
 H   -2.482000      0.2453000      -1.421200    
 H    2.076700      -2.355800       1.604000    
 H   -6.123900     -0.7331000     -0.3252000    
 H   -4.734500      -1.232400      0.6626000    
 H    3.736100      -3.947600      0.8142000    
 H    3.191000      -4.921200     -0.5696000    
 H    2.171200      -4.806200      0.8870000    
 H   -3.662700      -1.782500      -1.291100    
 H    2.866200       3.679800      -1.857300    


%chk=000034536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034536

0 1
I -1.246726 -2.380363 1.163098
I -0.866751 3.612762 -0.243258
I 4.243089 0.204055 0.197256
O -2.835347 1.079272 1.472931
O -4.614751 -2.117818 -0.786187
O 2.558524 3.119481 -1.447917
O 2.785318 3.586455 0.821483
O 1.174388 -2.948196 -1.354773
N -2.896082 0.334218 -0.736042
N 1.970291 -2.066994 0.655981
C -0.724698 0.569664 0.344221
C 1.333891 -0.801989 0.510971
C -0.080351 -0.669597 0.577898
C 1.490803 1.633629 0.092728
C 0.076666 1.712798 0.102003
C 2.102090 0.372089 0.281125
C -2.243371 0.688175 0.424660
C -4.369364 0.362816 -0.835365
C -5.018221 -0.858412 -0.149649
C 2.333867 2.871758 -0.095091
C 1.873071 -3.083310 -0.315580
C 2.644828 -4.351170 0.022796
H -4.634585 0.372699 -1.906324
H -4.738263 1.291133 -0.360846
H -2.345053 0.036550 -1.543806
H 2.644696 -2.183161 1.416234
H -6.112768 -0.806928 -0.271405
H -4.776368 -0.851686 0.931178
H 3.541638 -4.161754 0.638673
H 2.943658 -4.845240 -0.913982
H 1.984396 -5.044343 0.576568
H -3.661775 -2.288673 -0.565454
H 3.112162 3.942082 -1.551324


