%chk=000130640.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130640

0 1
 O   0.3486000      0.2142000       2.015400    
 O    4.340900      0.5804000     -0.4079000    
 N    2.253000      0.3678000     -0.2092000    
 N    3.345100     -9.3000000E-03 -0.8444000    
 C    1.268900     -0.6995000     -1.8800000E-02
 C   0.1118000     -0.1490000      0.8434000    
 C    1.928100      -1.884800      0.6740000    
 C   -1.239100     -6.7500003E-02  0.3115000    
 C    1.614300       1.517400     -0.8611000    
 C   -1.667400     -0.9847000     -0.6483000    
 C   -2.106900      0.9277000      0.7613000    
 C   -2.963300     -0.9066000      -1.158400    
 C   -3.402900       1.005600      0.2512000    
 C   -3.831000      8.8399999E-02 -0.7087000    
 H   0.9040000      -1.034400     -0.9953000    
 H    1.170800      -2.628400      0.9499000    
 H    2.656300      -2.393500      3.2900002E-02
 H    2.432000      -1.589400       1.602100    
 H    1.141700       1.248500      -1.814400    
 H    2.346700       2.309100      -1.069900    
 H   0.8661000       1.993800     -0.2190000    
 H   -1.036700      -1.796500     -0.9968000    
 H   -1.790000       1.654300       1.504900    
 H   -3.300000      -1.625800      -1.899500    
 H   -4.078600       1.780800      0.6006000    
 H   -4.840600      0.1480000      -1.104500    


%chk=000130640-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130640

0 1
O 0.413934 1.305566 1.235889
O 4.580742 0.589230 0.378751
N 2.463569 0.336786 -0.350611
N 3.525315 -0.143057 0.407953
C 1.204834 -0.426316 -0.300264
C 0.094760 0.397089 0.418709
C 1.361931 -1.795437 0.411483
C -1.344738 0.066336 0.146646
C 2.531273 1.607807 -1.089791
C -1.761248 -0.874438 -0.836111
C -2.333183 0.744827 0.913215
C -3.133629 -1.127253 -1.045098
C -3.701926 0.490123 0.705129
C -4.106692 -0.447368 -0.276138
H 0.892335 -0.604852 -1.349621
H 0.406699 -2.345289 0.364854
H 2.147541 -2.394760 -0.076117
H 1.645503 -1.660541 1.466583
H 2.088036 1.484287 -2.093729
H 3.595254 1.885201 -1.173244
H 1.995429 2.403045 -0.541330
H -1.027715 -1.411659 -1.446366
H -1.995975 1.466688 1.664464
H -3.445043 -1.851161 -1.805689
H -4.453631 1.017497 1.302045
H -5.171574 -0.645750 -0.440610


