%chk=000116139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116139

0 1
 O  -0.2201000       1.324400      0.6407000    
 O    2.251000       1.025800       1.548800    
 O    5.194300      0.9442000      -1.802100    
 N    3.526100     -0.3242000      0.1600000    
 C   -1.263200     -0.7061000     -8.3200000E-02
 C    1.117600     -0.6276000      0.3321000    
 C  -0.1245000      6.0999999E-03  0.2981000    
 C   -2.561900     -6.9700003E-02 -0.1243000    
 C   -1.155300      -2.053900     -0.4304000    
 C    1.223300      -1.974500     -1.5200000E-02
 C    2.318600      9.5600002E-02  0.7275000    
 C   8.6800002E-02  -2.687600     -0.3964000    
 C    4.803800      0.2764000      0.4695000    
 C   -3.377400     -7.4600004E-02   1.007300    
 C   -2.997600      0.5503000      -1.295300    
 C    5.120100       1.428000     -0.4673000    
 C   -4.628600      0.5408000      0.9679000    
 C   -4.248700       1.165700      -1.334600    
 C   -5.064300       1.161000     -0.2031000    
 H   -2.030600      -2.626800     -0.7285000    
 H    2.165200      -2.514000      2.7700000E-02
 H   0.1674000      -3.738200     -0.6599000    
 H    5.552100     -0.5161000      0.3648000    
 H    4.799600      0.6224000       1.507900    
 H    3.528500      -1.052500     -0.5466000    
 H   -3.052700     -0.5527000       1.928500    
 H   -2.374000      0.5640000      -2.186100    
 H    6.086100       1.874000     -0.2132000    
 H    4.354700       2.209500     -0.4239000    
 H   -5.263500      0.5374000       1.849000    
 H   -4.587900       1.648900      -2.246300    
 H   -6.038300       1.640300     -0.2337000    
 H   -1.133700       1.643000      0.5748000    
 H    4.328400      0.5595000      -2.021100    


%chk=000116139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116139

0 1
O 0.342262 0.865374 -0.587305
O 3.664402 -1.636038 0.344526
O 4.187205 2.480339 1.545542
N 2.973505 0.479504 -0.316690
C -1.191031 -0.993685 -0.097393
C 1.273805 -1.273474 0.112538
C 0.134931 -0.471319 -0.175555
C -2.374929 -0.134356 -0.406183
C -1.355029 -2.355507 0.255113
C 1.056223 -2.626276 0.479975
C 2.720511 -0.827533 0.056478
C -0.239727 -3.170669 0.545576
C 4.354041 0.977209 -0.439818
C -2.553463 1.134239 0.219735
C -3.363470 -0.578845 -1.326564
C 4.948609 1.385972 0.924296
C -3.681357 1.933337 -0.076767
C -4.491247 0.218288 -1.617262
C -4.652033 1.480830 -0.999001
H -2.370370 -2.761813 0.324662
H 1.947689 -3.221905 0.702571
H -0.383976 -4.217775 0.828930
H 4.340024 1.853490 -1.111833
H 4.985936 0.186043 -0.884834
H 2.174793 1.066262 -0.584671
H -1.846739 1.465147 0.990841
H -3.232194 -1.546055 -1.824623
H 5.966010 1.787264 0.784731
H 4.996406 0.500413 1.587984
H -3.807090 2.899765 0.423825
H -5.240941 -0.141293 -2.330682
H -5.526008 2.099969 -1.228080
H -0.521530 1.291438 -0.834245
H 3.266083 2.150458 1.707584


