%chk=000016822.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016822

0 1
 O   -2.458100       1.629100      0.1126000    
 O    4.425900       1.073500     -0.2366000    
 O   -3.616500     -0.8884000      0.3213000    
 C    1.929000     -0.3892000     -0.5970000    
 C    2.731000     -0.3297000      0.7090000    
 C   0.4633000     -0.5178000     -0.3543000    
 C  -0.3262000      0.6256000     -0.2318000    
 C    4.221600     -0.1487000      0.4588000    
 C  -0.1182000      -1.781400     -0.2493000    
 C   -1.697300      0.5053000     -4.4000000E-03
 C   -1.489100      -1.901700     -2.1900000E-02
 C   -2.278600     -0.7584000      0.1005000    
 C   -1.786700       2.881800     -6.8999999E-03
 H    2.117200      0.5050000      -1.204800    
 H    2.278700      -1.233000      -1.206100    
 H    2.569600      -1.243700       1.292800    
 H    2.366500      0.5103000       1.314400    
 H   0.1813000       1.580400     -0.3196000    
 H    4.764600     -0.1065000       1.407900    
 H    4.621600     -0.9701000     -0.1441000    
 H   0.4865000      -2.679900     -0.3409000    
 H   -1.928900      -2.892200      5.8100000E-02
 H    5.383500       1.163200     -0.3800000    
 H   -3.839800      -1.834000      0.3646000    
 H   -1.349000       3.012200      -1.002600    
 H   -1.053600       3.025200      0.7942000    
 H   -2.543000       3.664800      0.1117000    


%chk=000016822-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016822

0 1
O -2.507824 1.627695 0.142515
O 4.451270 1.145443 -0.240294
O -3.684657 -0.771338 0.343114
C 2.006978 -0.491320 -0.621351
C 2.797667 -0.342066 0.707165
C 0.505832 -0.596325 -0.398742
C -0.277172 0.580494 -0.252134
C 4.297852 -0.133134 0.482210
C -0.136782 -1.849848 -0.294627
C -1.666862 0.517528 -0.005935
C -1.528037 -1.927622 -0.046808
C -2.299742 -0.757613 0.099991
C -1.891995 2.949860 0.024037
H 2.250122 0.379220 -1.257639
H 2.372662 -1.392840 -1.152308
H 2.650466 -1.243904 1.333693
H 2.403032 0.517891 1.280754
H 0.218042 1.553533 -0.340112
H 4.824848 -0.093634 1.459548
H 4.718134 -0.972813 -0.114736
H 0.444402 -2.771840 -0.410820
H -2.018388 -2.907792 0.028428
H 5.411170 1.319465 -0.406233
H -4.006968 -1.706012 0.391591
H -1.439783 3.097294 -0.976599
H -1.121223 3.109241 0.803811
H -2.717747 3.662138 0.167079


