%chk=000148737.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148737

0 1
 O   -1.612900      -2.221000      0.6503000    
 O   -4.744900      0.1977000      -1.696100    
 O    4.548700      0.3616000     -0.9980000    
 N   -1.518400      0.1024000      0.7923000    
 N   -3.091600     -0.9793000     -0.5910000    
 C   -1.920200       1.363300      0.1836000    
 C  -0.3936000      0.1285000       1.713300    
 C   -3.408900       1.380900     -9.3900003E-02
 C   0.9217000      0.1905000      0.9919000    
 C   -2.030200      -1.110200      0.3156000    
 C   -3.810400      0.1716000     -0.8979000    
 C    1.478400       1.425600      0.6828000    
 C    1.568900     -0.9882000      0.6406000    
 C    2.700200       1.483200      1.2500000E-02
 C    2.790800     -0.9309000     -2.9800000E-02
 C    3.356600      0.3050000     -0.3438000    
 C    5.165600     -0.8807000      -1.332400    
 H   -1.354100       1.473400     -0.7489000    
 H   -1.665000       2.194100      0.8497000    
 H  -0.4237000     -0.7713000       2.340600    
 H  -0.5106000      0.9765000       2.399100    
 H   -3.678200       2.286400     -0.6471000    
 H   -3.978500       1.362700      0.8423000    
 H   -3.405300      -1.835900      -1.039000    
 H   0.9783000       2.350200      0.9569000    
 H    1.141500      -1.957000      0.8830000    
 H    3.136200       2.448700     -0.2291000    
 H    3.246800      -1.883800     -0.2759000    
 H    4.552100      -1.459400      -2.031300    
 H    5.427200      -1.454100     -0.4367000    
 H    6.103200     -0.6477000      -1.847800    


%chk=000148737-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148737

0 1
O -1.801447 -2.197889 1.103963
O -4.839218 -0.084319 -1.713430
O 4.657720 0.409343 -0.885899
N -1.597745 0.133930 0.864210
N -3.210225 -1.081422 -0.385618
C -1.875266 1.303142 0.000548
C -0.442859 0.191845 1.798983
C -3.369927 1.367857 -0.361010
C 0.908290 0.225003 1.092703
C -2.156168 -1.100470 0.579464
C -3.882532 0.036258 -0.903506
C 1.666188 1.422108 1.010060
C 1.431280 -0.947204 0.493104
C 2.907249 1.453907 0.346865
C 2.673093 -0.934398 -0.178753
C 3.413879 0.273445 -0.252103
C 5.232060 -0.781915 -1.516844
H -1.255281 1.259263 -0.918489
H -1.579837 2.212859 0.551978
H -0.524113 -0.701588 2.441074
H -0.569373 1.090861 2.431051
H -3.561891 2.143387 -1.120100
H -3.971044 1.619374 0.534369
H -3.562604 -2.007483 -0.648141
H 1.287038 2.339457 1.478607
H 0.858311 -1.879876 0.558044
H 3.501245 2.370621 0.283206
H 3.051238 -1.857878 -0.627304
H 4.578935 -1.164544 -2.325177
H 5.412899 -1.583435 -0.774536
H 6.189804 -0.447437 -1.941517


