%chk=000020627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020627

0 1
 O    4.167400      -1.662800      2.2700001E-02
 O    2.192900      -2.496800      0.4970000    
 N  -0.9698000       1.380000      0.3035000    
 N    2.932600      -1.527800      0.1998000    
 C   0.4142000       1.203200      0.1114000    
 C   -2.077900      0.5304000      0.1051000    
 C   0.9835000     -6.3699998E-02  0.2501000    
 C    1.219200       2.294900     -0.2184000    
 C    2.354300     -0.2384000      5.9400000E-02
 C    2.589800       2.120100     -0.4090000    
 C   -3.213300      0.6664000      0.9039000    
 C   -2.038300     -0.4464000     -0.8901000    
 C    3.157400      0.8535000     -0.2702000    
 C   -4.308900     -0.1744000      0.7079000    
 C   -3.134000      -1.287100      -1.086100    
 C   -4.269200      -1.151100     -0.2871000    
 H   -1.219500       2.300300      0.6548000    
 H   0.3551000     -0.9051000      0.5313000    
 H   0.7888000       3.286700     -0.3305000    
 H    3.214800       2.970500     -0.6659000    
 H   -3.256000       1.423000       1.683200    
 H   -1.176600     -0.5607000      -1.541800    
 H    4.228600      0.7552000     -0.4263000    
 H   -5.192900     -6.8599999E-02   1.329900    
 H   -3.105500      -2.044300      -1.864100    
 H   -5.122800      -1.804900     -0.4405000    


%chk=000020627-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020627

0 1
O 4.272468 -1.649575 -0.122877
O 2.196526 -2.569494 0.064048
N -0.987539 1.411931 0.214170
N 2.988112 -1.554150 -0.036272
C 0.391481 1.199147 0.058354
C -2.069640 0.500915 0.080860
C 0.987326 -0.090949 0.078000
C 1.241914 2.339957 -0.074206
C 2.385516 -0.192921 -0.055589
C 2.637337 2.198221 -0.189721
C -3.276001 0.798920 0.773870
C -2.020612 -0.647151 -0.755996
C 3.239676 0.921610 -0.192296
C -4.404259 -0.034268 0.637623
C -3.152427 -1.481973 -0.872256
C -4.348969 -1.187673 -0.179444
H -1.254122 2.361641 0.479871
H 0.404584 -1.000486 0.231248
H 0.794992 3.341708 -0.091993
H 3.260929 3.092364 -0.289807
H -3.321272 1.679279 1.427499
H -1.124910 -0.871808 -1.341335
H 4.317154 0.778125 -0.293821
H -5.324123 0.212261 1.179277
H -3.098303 -2.362707 -1.521667
H -5.221939 -1.840823 -0.277537


