%chk=000114829.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114829

0 1
 O   0.2957000     -0.6770000     -0.1517000    
 O    1.818300       3.130300     -2.5900001E-02
 O    4.642700      -2.566500     -1.6200000E-02
 O   -5.971300     -0.7899000     -0.2509000    
 C  -0.4727000      0.4025000      0.4021000    
 C  -0.1141000       1.729000     -0.2650000    
 C   -1.942400      8.3300002E-02  0.2271000    
 C    1.355600       1.996700     -6.9600001E-02
 C    2.226700      0.8052000     -5.1000002E-03
 C    1.647900     -0.4656000     -7.2499998E-02
 C   -2.755400     -9.0599999E-02   1.346700    
 C   -2.482300     -3.5599999E-02  -1.053100    
 C    3.614200      0.9453000      7.7900000E-02
 C    2.462400      -1.598500     -9.1100000E-02
 C    3.848500      -1.460800     -9.8999999E-03
 C    4.422300     -0.1922000      7.9400003E-02
 C   -4.109500     -0.3838000       1.186000    
 C   -3.836500     -0.3288000      -1.213900    
 C   -4.650100     -0.5030000     -9.4300002E-02
 H  -0.2452000      0.4561000       1.477100    
 H  -0.6866000       2.548500      0.1840000    
 H  -0.2935000       1.721500      -1.346000    
 H   -2.349200     -7.9999998E-04   2.350600    
 H   -1.863100      8.4899999E-02  -1.937700    
 H    4.081400       1.924600      0.1311000    
 H    2.019100      -2.589000     -0.1581000    
 H    5.501100     -7.5700000E-02  0.1423000    
 H   -4.738300     -0.5185000       2.061900    
 H   -4.244900     -0.4216000      -2.216600    
 H    5.572300      -2.287300      4.7100000E-02
 H   -6.173300     -0.8352000      -1.201300    


%chk=000114829-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114829

0 1
O 0.315507 -0.687806 -0.058725
O 1.853081 3.215984 0.299996
O 4.674686 -2.603200 -0.367444
O -6.077449 -0.736355 -0.352210
C -0.515953 0.414850 0.537759
C -0.088360 1.768229 -0.067282
C -1.966405 0.066109 0.290172
C 1.404275 2.040118 0.149332
C 2.266041 0.838269 0.107333
C 1.695581 -0.465653 -0.050003
C -2.922077 0.197087 1.328083
C -2.402711 -0.353488 -0.990335
C 3.681845 0.957955 0.127435
C 2.513041 -1.601379 -0.214033
C 3.912563 -1.441368 -0.203979
C 4.511308 -0.160160 -0.023408
C -4.287051 -0.065984 1.098790
C -3.762842 -0.633213 -1.232324
C -4.706058 -0.481632 -0.185448
H -0.303088 0.418973 1.627249
H -0.678768 2.590691 0.371380
H -0.291894 1.761562 -1.157436
H -2.599521 0.507340 2.329444
H -1.669508 -0.490850 -1.792024
H 4.100645 1.962915 0.245875
H 2.069748 -2.592899 -0.329343
H 5.602929 -0.053294 -0.012810
H -5.031724 0.033834 1.893497
H -4.086945 -0.969528 -2.225918
H 5.643005 -2.402005 -0.332165
H -6.274102 -1.027603 -1.277059


