%chk=000051830.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051830

0 1
 O   0.8598000      0.1970000      0.5837000    
 O   0.5860000      0.1526000      -1.741600    
 C   -1.323800      3.7900001E-02 -0.2722000    
 C   -3.653500     -0.1418000      -1.227300    
 C   -3.258900       1.163300      0.8945000    
 C   -3.069000      -1.352200      0.9073000    
 C   -2.157000     -3.1500001E-02  -1.567600    
 C   -1.763800       1.268300      0.5459000    
 C   -1.574800      -1.236200      0.5581000    
 C   -4.077200       1.088300     -0.4061000    
 C   -3.889200      -1.413000     -0.3931000    
 C   -3.496600     -0.1154000       1.716700    
 C   0.1380000      0.1337000     -0.6029000    
 C    2.237800      0.2884000      0.3740000    
 C    2.973000     -0.8732000      0.2897000    
 C    2.808000       1.537000      0.2604000    
 C    4.349200     -0.7813000      8.1000000E-02
 C    4.184100       1.628800      5.1600002E-02
 C    4.954700      0.4697000     -3.8100000E-02
 C    5.173300      -2.020500     -1.4200000E-02
 H   -4.240800     -0.1907000      -2.151000    
 H   -3.566400       2.039900       1.475300    
 H   -3.242500      -2.259200       1.497000    
 H   -1.853600     -0.8938000      -2.176200    
 H   -1.984200      0.8599000      -2.185100    
 H   -1.575100       2.189300     -2.1400001E-02
 H   -1.184600       1.357000       1.474000    
 H  -0.9904000      -1.228600       1.487200    
 H   -1.251100      -2.124900      3.0000001E-04
 H   -3.928200       2.001500     -0.9954000    
 H   -5.147400       1.031300     -0.1720000    
 H   -4.956000      -1.514000     -0.1584000    
 H   -3.605400      -2.299600     -0.9734000    
 H   -2.930400     -6.7900002E-02   2.655000    
 H   -4.556500     -0.1939000       1.988100    
 H    2.489700      -1.841400      0.3832000    
 H    2.208200       2.439000      0.3310000    
 H    4.655300       2.602900     -4.1299999E-02
 H    6.025600      0.5542000     -0.2026000    
 H    5.229100      -2.355400      -1.054800    
 H    6.190300      -1.848200      0.3543000    
 H    4.745800      -2.826900      0.5915000    


%chk=000051830-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051830

0 1
O 0.881684 0.143563 0.377330
O 0.529049 -0.898819 -1.700573
C -1.401448 -0.202212 -0.304443
C -3.783492 -0.580072 -1.107352
C -3.238388 1.456472 0.299598
C -3.227237 -0.851583 1.351493
C -2.282729 -0.738214 -1.467751
C -1.734906 1.306854 -0.056461
C -1.723833 -1.008370 0.999849
C -4.107270 0.919718 -0.869624
C -4.095697 -1.388280 0.181787
C -3.548879 0.648799 1.589290
C 0.075006 -0.374597 -0.660898
C 2.311376 0.128085 0.413043
C 3.147350 -0.574264 -0.482487
C 2.844996 0.879760 1.485159
C 4.556348 -0.524492 -0.303922
C 4.241876 0.926082 1.655866
C 5.094893 0.228509 0.767485
C 5.459654 -1.278293 -1.265841
H -4.396910 -0.965338 -1.945358
H -3.459990 2.528781 0.468972
H -3.440802 -1.429277 2.272562
H -2.040596 -1.800688 -1.659819
H -2.047175 -0.186549 -2.397796
H -1.501256 1.892855 -0.967743
H -1.102331 1.696647 0.762008
H -1.091394 -0.639831 1.828546
H -1.481174 -2.078520 0.843774
H -3.907666 1.502824 -1.791201
H -5.182529 1.043949 -0.630734
H -5.170739 -1.298775 0.436278
H -3.886352 -2.464110 0.015304
H -2.948567 1.038024 2.436091
H -4.616630 0.768095 1.861421
H 2.715563 -1.141894 -1.308321
H 2.163105 1.407156 2.158618
H 4.667102 1.505709 2.482432
H 6.181158 0.269667 0.907639
H 5.325927 -0.919639 -2.303537
H 6.523643 -1.156983 -1.000026
H 5.230759 -2.360348 -1.265557


