%chk=000162113.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162113

0 1
 O  -0.9788000      -1.886800      3.0800000E-02
 O   -4.601800      -1.472200      0.5938000    
 O  -0.2327000       2.475100       1.601900    
 C   -2.024200      0.2350000      0.5271000    
 C   -2.202300      -1.304300      0.5556000    
 C   -3.447900      -1.822700     -0.1822000    
 C   -2.330500      0.8843000     -0.8416000    
 C   -3.608200      -1.168900      -1.558600    
 C   -3.627100      0.3556000      -1.457800    
 C  -0.5533000      0.2456000      0.7945000    
 C  -2.1900000E-02 -0.9919000      0.4470000    
 C   -3.433000      -3.347600     -0.3248000    
 C   -2.399200       2.380200     -0.7336000    
 C   0.2658000       1.265400       1.243100    
 C    1.331800      -1.253900      0.5076000    
 C   -1.412600       3.149200      -1.561400    
 C    2.167800     -0.2320000      0.9608000    
 C    1.638400       1.017000       1.329800    
 C   -3.292000       2.993700      5.7300001E-02
 C    3.638600     -0.4667000       1.055700    
 C    4.421900     -0.1106000     -0.2206000    
 C    5.916500     -0.4273000     -0.1084000    
 C    6.653700     -8.4100001E-02  -1.403600    
 C    8.131000     -0.4321000      -1.312400    
 H   -2.597200      0.6745000       1.350800    
 H   -2.274300      -1.628800       1.607500    
 H   -1.525800      0.6245000      -1.546100    
 H   -4.549300      -1.490000      -2.023100    
 H   -2.795600      -1.481500      -2.226300    
 H   -3.758300      0.7731000      -2.464600    
 H   -4.505500      0.6662000     -0.8788000    
 H   -2.603700      -3.694000     -0.9496000    
 H   -3.352100      -3.826200      0.6578000    
 H   -4.368200      -3.709100     -0.7680000    
 H   -5.390300      -1.802000      0.1300000    
 H    1.724400      -2.223000      0.2192000    
 H  -0.3867000       2.864700      -1.308700    
 H   -1.574700       2.948100      -2.625500    
 H   -1.503000       4.230000      -1.410000    
 H    2.307200       1.800500       1.680300    
 H   -3.328800       4.076200      0.1250000    
 H   -4.008600       2.442100      0.6560000    
 H    4.046200      0.1037000       1.900900    
 H    3.819600      -1.520000       1.308700    
 H   0.5005000       3.049300       1.882300    
 H    4.289000      0.9558000     -0.4430000    
 H    3.998400     -0.6616000      -1.070200    
 H    6.349900      0.1377000      0.7255000    
 H    6.047500      -1.492200      0.1186000    
 H    6.547100      0.9852000      -1.620300    
 H    6.208200     -0.6314000      -2.242500    
 H    8.271400      -1.502300      -1.130100    
 H    8.638900     -0.1774000      -2.247800    
 H    8.614700      0.1214000     -0.5013000    


%chk=000162113-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162113

0 1
O -0.993022 -1.870143 0.086404
O -4.641281 -1.567204 0.590054
O -0.329718 2.504919 1.814834
C -2.091342 0.254088 0.553475
C -2.307510 -1.291455 0.567384
C -3.459036 -1.885042 -0.265952
C -2.382623 0.917422 -0.845614
C -3.604797 -1.177684 -1.630960
C -3.688266 0.350641 -1.464505
C -0.601605 0.293578 0.891713
C -0.021918 -0.943721 0.521486
C -3.324297 -3.410720 -0.411705
C -2.412079 2.451483 -0.767876
C 0.246834 1.287439 1.406427
C 1.351260 -1.218109 0.593647
C -1.267770 3.175660 -1.451308
C 2.201823 -0.194718 1.093485
C 1.643487 1.040390 1.509007
C -3.414388 3.121486 -0.140950
C 3.706341 -0.418367 1.156387
C 4.404955 -0.172744 -0.210313
C 5.927461 -0.429688 -0.162372
C 6.624452 -0.195439 -1.522254
C 8.145350 -0.458199 -1.471957
H -2.723381 0.733462 1.318685
H -2.428716 -1.628048 1.616445
H -1.550715 0.623664 -1.519837
H -4.509613 -1.566407 -2.141437
H -2.735309 -1.443792 -2.264592
H -3.861042 0.835120 -2.444117
H -4.549357 0.602312 -0.818274
H -2.401545 -3.674886 -0.954266
H -3.291535 -3.890876 0.582015
H -4.189167 -3.819359 -0.970105
H -5.446538 -1.938436 0.146842
H 1.748392 -2.193798 0.298265
H -0.299373 2.870263 -1.010582
H -1.223723 2.919743 -2.529190
H -1.360685 4.271823 -1.359600
H 2.304455 1.814958 1.921901
H -3.425445 4.216251 -0.090908
H -4.241810 2.603744 0.358903
H 4.160138 0.250067 1.914227
H 3.920488 -1.457033 1.477700
H 0.364244 3.110471 2.177066
H 4.210936 0.869653 -0.534771
H 3.940871 -0.827325 -0.975249
H 6.390174 0.227371 0.604006
H 6.114540 -1.472664 0.169700
H 6.437535 0.846607 -1.852606
H 6.159524 -0.851309 -2.286307
H 8.356585 -1.500914 -1.167706
H 8.619156 -0.290908 -2.456757
H 8.639502 0.209871 -0.741288


