%chk=000126750.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126750

0 1
 O    2.254200      -1.878800      -1.547100    
 O   -3.247200      4.5699999E-02 -0.3616000    
 O   -2.168000      -1.496600      0.9634000    
 N  -5.6600001E-02   2.598500     -0.2849000    
 C    2.697000     -3.9799999E-02 -1.4300000E-02
 C    2.199000      -1.497700     -0.1686000    
 C   0.7357000      -1.544400      0.3124000    
 C    1.401300      0.7131000     -8.0399998E-02
 C   0.3028000     -0.1276000      9.3400002E-02
 C    3.401700      0.1902000       1.317700    
 C  -0.9814000      0.3790000      9.2299998E-02
 C    1.184200       2.059700     -0.2653000    
 C   -1.101900       1.746800     -0.1050000    
 C   -2.152300     -0.4564000      0.2895000    
 C   -4.468500     -0.6916000     -0.2416000    
 H    3.346700      0.2454000     -0.8495000    
 H    2.822300      -2.217300      0.3717000    
 H   0.6836000      -1.779000       1.380600    
 H   0.1398000      -2.252000     -0.2713000    
 H    2.767300     -8.0600001E-02   2.169400    
 H    4.316600     -0.4087000       1.375200    
 H    3.681000       1.243000       1.436200    
 H    2.000900       2.758500     -0.4033000    
 H    1.703800      -1.260400      -2.056900    
 H   -2.068500       2.242500     -0.1146000    
 H   -4.777200     -0.7411000      0.8068000    
 H   -4.344100      -1.696600     -0.6557000    
 H   -5.240000     -0.1680000     -0.8121000    


%chk=000126750-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126750

0 1
O 2.517584 -1.952833 -1.548927
O -3.383338 0.191187 -0.121397
O -2.161381 -1.731588 0.360095
N -0.072501 2.627014 -0.441370
C 2.737032 -0.025010 0.053246
C 2.306341 -1.516770 -0.155902
C 0.800258 -1.577719 0.239100
C 1.420644 0.724547 -0.118001
C 0.313821 -0.156438 0.017583
C 3.354060 0.222831 1.455924
C -0.997554 0.374328 -0.071836
C 1.189201 2.094642 -0.342986
C -1.126932 1.775888 -0.304491
C -2.188940 -0.505761 0.080889
C -4.621529 -0.611683 0.019100
H 3.481829 0.249184 -0.716774
H 2.930063 -2.215070 0.423254
H 0.666296 -1.863306 1.300367
H 0.248978 -2.331385 -0.346502
H 2.656857 -0.078735 2.259256
H 4.289544 -0.353179 1.574407
H 3.589349 1.292354 1.601445
H 2.014746 2.807004 -0.456970
H 1.945567 -1.405247 -2.146687
H -2.122661 2.220630 -0.384314
H -4.688638 -1.035202 1.035147
H -4.628845 -1.432962 -0.716857
H -5.437651 0.099079 -0.170402


