%chk=000036868.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036868

0 1
 O    2.587600      0.9950000       1.326200    
 O    3.708000     -0.2345000     -0.4175000    
 O   -2.396700      0.5890000      0.4089000    
 O   -1.538400       1.624000      -1.469500    
 C  -0.3751000     -0.5743000     -0.1647000    
 C   -1.858700     -0.6662000     -3.3500001E-02
 C    1.721000      0.2756000      0.5621000    
 C   0.3516000      0.2223000      0.7233000    
 C    2.360800     -0.4263000     -0.4337000    
 C   0.2787000      -1.291500      -1.182200    
 C    1.666700      -1.220200      -1.323300    
 C    3.844700      0.6665000      0.7001000    
 C   -2.299200      -1.741200      0.9333000    
 C   -2.156300       1.647000     -0.4137000    
 C   -3.121800      -2.746700      0.6132000    
 C   -2.773000       2.881400      0.1711000    
 H   -2.303500     -0.8698000      -1.018100    
 H  -0.1214000      0.7741000       1.528600    
 H  -0.2904000      -1.911500      -1.870600    
 H    2.174600      -1.771600      -2.106400    
 H    4.498100      0.2020000       1.447500    
 H    4.314200       1.592600      0.3490000    
 H   -1.937000      -1.676700       1.956900    
 H   -3.407200      -3.481100       1.358400    
 H   -3.521900      -2.855700     -0.3887000    
 H   -2.328000       3.091100       1.147100    
 H   -3.854200       2.749500      0.2603000    
 H   -2.579000       3.731200     -0.4895000    


%chk=000036868-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036868

0 1
O 2.893102 0.342860 1.699062
O 3.906100 -0.219932 -0.407442
O -2.338612 0.742376 0.374499
O -2.655743 1.222512 -1.892479
C -0.273515 -0.516112 -0.151313
C -1.782926 -0.624776 -0.002476
C 1.902828 -0.040092 0.758853
C 0.525888 -0.105064 0.959029
C 2.499767 -0.369183 -0.478183
C 0.330452 -0.833936 -1.391420
C 1.738535 -0.769370 -1.577570
C 4.190217 0.245493 0.977842
C -2.230577 -1.554225 1.100053
C -2.710674 1.572707 -0.691756
C -3.040102 -2.620875 0.894790
C -3.157980 2.923356 -0.174476
H -2.236584 -0.910017 -0.967807
H 0.078305 0.170524 1.917417
H -0.304360 -1.122797 -2.235311
H 2.204030 -1.011984 -2.535743
H 4.827818 -0.500317 1.482800
H 4.652642 1.246674 0.931605
H -1.850172 -1.335072 2.106920
H -3.329641 -3.286330 1.715333
H -3.434115 -2.863286 -0.099998
H -2.269123 3.547343 0.031709
H -3.719719 2.816700 0.766875
H -3.771643 3.426823 -0.936213


