%chk=000019984.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019984

0 1
 O    1.539600       1.458200     -0.6473000    
 O    2.473200     -6.7199998E-02  0.8696000    
 O  -0.7500000      -1.386600     -0.2677000    
 O   -1.842100       1.136200      0.7168000    
 O   -2.612400     -0.1964000      -1.054200    
 O   0.6424000      -3.769000     -0.2984000    
 C   0.5464000       1.111000      0.3234000    
 C    1.049500     -0.2192000      0.8487000    
 C  -0.8335000       1.059400     -0.2995000    
 C   -1.180900     -0.2398000      -1.001500    
 C   0.6597000      -1.392300     -5.7300001E-02
 C    2.766800      0.9659000     -8.6000003E-02
 C   -3.002900      0.5387000      0.1176000    
 C    1.035500      -2.727100      0.5765000    
 C    3.490400       2.101000      0.6355000    
 C    3.636700      0.4034000      -1.202900    
 C   -3.978400       1.633300     -0.2989000    
 C   -3.639800     -0.4095000       1.125700    
 H   0.5776000       1.868300       1.117200    
 H   0.6792000     -0.3895000       1.866200    
 H  -0.9858000       1.909100     -0.9770000    
 H  -0.7824000     -0.2922000      -2.020300    
 H    1.152000      -1.335900      -1.035600    
 H   0.5182000      -2.879400       1.529600    
 H    2.113900      -2.803300      0.7436000    
 H    4.432700       1.754600       1.073100    
 H    3.693600       2.935900     -4.3099999E-02
 H    2.882200       2.493300       1.458100    
 H    3.118800     -0.4006000      -1.735500    
 H    3.877100       1.173200      -1.943900    
 H    4.566400     -1.8999999E-02 -0.8077000    
 H   -4.277800       2.245700      0.5580000    
 H   -3.515900       2.305300      -1.030800    
 H   -4.872100       1.210800     -0.7701000    
 H   -2.928400      -1.184400       1.432300    
 H   -3.945000      0.1223000       2.033000    
 H   -4.508800     -0.9197000      0.6973000    
 H  -0.3161000      -3.687300     -0.4411000    


%chk=000019984-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019984

0 1
O 1.582383 1.426537 -0.681426
O 2.540931 -0.111028 0.851179
O -0.812789 -1.442164 -0.216028
O -1.856531 1.278463 0.616624
O -2.670640 -0.232125 -1.029335
O 0.561492 -3.894190 -0.373971
C 0.545368 1.072554 0.318676
C 1.069153 -0.279589 0.860628
C -0.806234 1.052246 -0.400194
C -1.238719 -0.292531 -1.037989
C 0.665183 -1.456310 -0.047049
C 2.879545 1.011778 -0.094492
C -3.099396 0.597328 0.153996
C 0.988204 -2.831988 0.536601
C 3.505823 2.144657 0.727830
C 3.766262 0.494928 -1.224634
C -4.114792 1.617023 -0.361368
C -3.597613 -0.304380 1.281625
H 0.509466 1.830554 1.125089
H 0.758751 -0.463407 1.903463
H -0.823238 1.852972 -1.166442
H -0.902596 -0.433744 -2.081348
H 1.148074 -1.347176 -1.041686
H 0.497026 -2.933941 1.528730
H 2.077148 -2.944493 0.658941
H 4.388082 1.766383 1.271942
H 3.819567 2.970929 0.066773
H 2.787015 2.534812 1.468188
H 3.275121 -0.343395 -1.745015
H 3.962675 1.300867 -1.952649
H 4.728674 0.143415 -0.816168
H -4.479995 2.241761 0.471380
H -3.652309 2.268946 -1.120880
H -4.973110 1.095848 -0.819065
H -2.827766 -1.054835 1.519910
H -3.811128 0.300240 2.180273
H -4.522048 -0.821627 0.973009
H -0.387440 -3.708117 -0.601717


