%chk=000126848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126848

0 1
 O   -4.229500      -1.529500     -6.5200001E-02
 O   -2.590000      -2.991100      5.0700001E-02
 O   -2.471100       3.399600      0.8409000    
 N   -3.012200      -1.815600     -2.2399999E-02
 N   -2.245000       2.888400     -0.2632000    
 C   0.2096000      0.1127000     -5.5599999E-02
 C    1.608900     -0.1067000     -1.2000000E-02
 C  -0.6798000     -0.9863000     -1.5500000E-02
 C  -0.2970000       1.430600     -0.1392000    
 C    2.115500      -1.424600      7.1599998E-02
 C    2.498300      0.9923000     -5.2099999E-02
 C   -2.062100     -0.7527000     -5.9500001E-02
 C  -0.1596000      -2.284900      6.7299999E-02
 C   0.5993000       2.507100     -0.1779000    
 C   -1.684500       1.631200     -0.1814000    
 C    1.219200      -2.501100      0.1103000    
 C    1.978100       2.290900     -0.1349000    
 C   -2.559300      0.5469000     -0.1418000    
 C    3.502900      -1.625200      0.1139000    
 C    3.880500      0.7587000     -8.2000000E-03
 C    4.377800     -0.5409000      7.4199997E-02
 H  -0.6682000      -3.231600      0.1078000    
 H   0.2589000       3.538000     -0.2436000    
 H    1.590700      -3.522400      0.1746000    
 H    2.643300       3.151500     -0.1674000    
 H   -3.630200      0.7430000     -0.1773000    
 H    3.915600      -2.629800      0.1781000    
 H    4.583600       1.588400     -3.7799999E-02
 H    5.450500     -0.7090000      0.1076000    


%chk=000126848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126848

0 1
O -4.375964 -1.386704 0.026089
O -2.817156 -3.031856 0.073200
O -3.391573 3.207870 -0.096143
N -3.145568 -1.780520 0.040162
N -2.113719 3.053812 -0.083973
C 0.246617 0.097642 -0.005416
C 1.669299 -0.122321 0.001519
C -0.667434 -1.033367 0.024012
C -0.244227 1.455749 -0.042090
C 2.199561 -1.459702 0.038323
C 2.582011 0.993509 -0.028039
C -2.081801 -0.732740 0.014059
C -0.100760 -2.361596 0.061177
C 0.683048 2.559251 -0.071091
C -1.663057 1.670640 -0.048748
C 1.273211 -2.557690 0.067861
C 2.048807 2.332815 -0.064454
C -2.560038 0.583218 -0.021736
C 3.608410 -1.662693 0.044760
C 3.983269 0.750616 -0.020562
C 4.491838 -0.565411 0.015513
H -0.776591 -3.214109 0.084157
H 0.271615 3.570646 -0.098084
H 1.669860 -3.579287 0.096508
H 2.748165 3.176418 -0.086911
H -3.637124 0.778606 -0.028467
H 3.999292 -2.686078 0.072911
H 4.670751 1.603928 -0.043269
H 5.573459 -0.732745 0.020729


