%chk=000170457.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170457

0 1
 O    4.779000     -0.1326000       1.267200    
 O    4.368600     -5.7200000E-02 -0.9655000    
 C   0.1296000     -1.0100000E-02 -0.3373000    
 C  -0.5057000       1.233500     -0.1835000    
 C  -0.5753000      -1.215700     -0.1849000    
 C    1.596500     -5.1700000E-02 -0.6727000    
 C   -1.881800       1.272400      0.1308000    
 C   -1.951500      -1.176800      0.1292000    
 C   -2.586900      6.6799998E-02  0.2830000    
 C    2.496800     -7.7799998E-02  0.5612000    
 C   0.1985000       2.439500     -0.3356000    
 C   5.9200000E-02  -2.459600     -0.3384000    
 C   -2.516300       2.516300      0.2846000    
 C   -2.655800      -2.382800      0.2812000    
 C  -0.4467000       3.666400     -0.1796000    
 C  -0.6548000      -3.648000     -0.1839000    
 C   -1.802400       3.704800      0.1302000    
 C   -2.010600      -3.609600      0.1255000    
 C    3.959600     -7.8000002E-02  0.1884000    
 H    1.876400      0.7785000      -1.331500    
 H    1.832500     -0.8951000      -1.332000    
 H   -3.649200      9.6900001E-02  0.5255000    
 H    2.311400      0.8014000       1.188300    
 H    2.299400     -0.9760000       1.157000    
 H    1.260200       2.491100     -0.5513000    
 H    1.116300      -2.571100     -0.5547000    
 H   -3.575700       2.570100      0.5272000    
 H   -3.716600      -2.376500      0.5236000    
 H   0.1103000       4.591800     -0.2941000    
 H  -0.1513000      -4.603500     -0.2995000    
 H   -2.305100       4.659700      0.2534000    
 H   -2.566800      -4.534500      0.2474000    
 H    5.725100     -0.1449000       1.008300    


%chk=000170457-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170457

0 1
O 4.790483 -0.125842 1.369665
O 4.551157 -0.090621 -0.939245
C 0.177010 -0.012896 -0.413004
C -0.482744 1.244951 -0.226727
C -0.553118 -1.231593 -0.229916
C 1.659706 -0.052950 -0.761591
C -1.900412 1.278686 0.128128
C -1.970806 -1.184519 0.124147
C -2.607795 0.066000 0.288901
C 2.541345 -0.065383 0.512357
C 0.196568 2.513758 -0.362106
C 0.052357 -2.536966 -0.367882
C -2.557021 2.548454 0.314367
C -2.699418 -2.415103 0.305799
C -0.467902 3.721343 -0.170188
C -0.680638 -3.704901 -0.179910
C -1.863683 3.743808 0.170924
C -2.075911 -3.647884 0.159464
C 4.022700 -0.094242 0.194778
H 1.945935 0.809422 -1.385641
H 1.902476 -0.937485 -1.372716
H -3.671826 0.095740 0.555772
H 2.339446 0.822271 1.142030
H 2.305687 -0.938171 1.150670
H 1.258690 2.533038 -0.624700
H 1.112054 -2.616064 -0.628871
H -3.622088 2.549607 0.575807
H -3.763119 -2.356124 0.566120
H 0.074120 4.667037 -0.281092
H -0.193689 -4.679871 -0.292902
H -2.371242 4.703520 0.316059
H -2.638098 -4.577200 0.300924
H 5.756676 -0.142118 1.128076


