%chk=000114703.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114703

0 1
 O   -2.162700      -1.038100      8.2599998E-02
 O    2.487600      -1.835800      0.2967000    
 O    3.998900      0.3369000      0.7270000    
 C   -3.307300     -0.1634000     -1.7400000E-02
 C   -3.005400       1.313800     -0.1116000    
 C  -0.9081000     -0.4972000      8.6700000E-02
 C  -0.6562000      0.8734000     -1.6000000E-03
 C   -4.159900     -0.4252000       1.229800    
 C   -4.076800     -0.6017000      -1.268900    
 C   -1.765000       1.806200     -0.1049000    
 C   0.6659000       1.333900      1.0100000E-02
 C   0.1534000      -1.400600      0.1860000    
 C    1.724300      0.4296000      0.1093000    
 C    1.468100     -0.9370000      0.1973000    
 C    3.090100      0.9356000      0.1202000    
 C    3.436600       2.222400     -0.6188000    
 C    3.016300      -2.352800     -0.9225000    
 H   -3.842200       2.003800     -0.1885000    
 H   -4.405400      -1.490100       1.318600    
 H   -3.610600     -0.1592000       2.140900    
 H   -5.096200      0.1435000       1.214600    
 H   -3.467100     -0.4639000      -2.170000    
 H   -4.320800      -1.669700      -1.223300    
 H   -5.009400     -4.0899999E-02  -1.395700    
 H   -1.576700       2.870800     -0.1740000    
 H   0.8531000       2.404100     -4.4300001E-02
 H  -4.5600001E-02  -2.467500      0.2557000    
 H    3.294900       3.077300      4.6700001E-02
 H    2.823900       2.331800      -1.517700    
 H    4.482200       2.178600     -0.9387000    
 H    3.382100      -1.545100      -1.564400    
 H    2.254600      -2.934800      -1.450900    
 H    3.853900      -3.012400     -0.6799000    


%chk=000114703-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114703

0 1
O -2.343125 -1.066200 -0.361498
O 2.214000 -2.247760 -0.118066
O 3.934527 0.117078 0.767737
C -3.483440 -0.099813 -0.085887
C -3.120945 1.312789 -0.522615
C -1.033178 -0.600845 -0.276720
C -0.722948 0.793005 -0.399419
C -3.750523 -0.152693 1.437219
C -4.656206 -0.676293 -0.895852
C -1.826958 1.727828 -0.623087
C 0.629056 1.170016 -0.349040
C -0.009882 -1.552789 -0.180039
C 1.702471 0.243814 -0.172014
C 1.351596 -1.157525 -0.150338
C 3.052889 0.789588 0.143866
C 3.365619 2.243128 -0.229998
C 3.549993 -2.211378 -0.738110
H -3.958591 1.994165 -0.711017
H -3.991217 -1.185548 1.745164
H -2.864125 0.190069 1.998607
H -4.599741 0.503904 1.700665
H -4.431393 -0.652394 -1.975199
H -4.843257 -1.722236 -0.598666
H -5.572882 -0.087983 -0.710366
H -1.589876 2.763401 -0.894393
H 0.862597 2.238091 -0.413483
H -0.246866 -2.619227 -0.161517
H 2.890765 2.941344 0.485682
H 3.017526 2.505038 -1.244447
H 4.455498 2.385069 -0.162996
H 4.286723 -1.808793 -0.026800
H 3.539926 -1.589531 -1.653425
H 3.762466 -3.261019 -0.994845


