%chk=000011303.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011303

0 1
 O    4.026200      -2.413400     -0.9866000    
 O   -4.765900     -0.5987000      -1.072700    
 C   0.3153000      0.4996000     -0.2569000    
 C    1.752000       1.131500     -8.8000000E-02
 C  -0.4703000      0.4462000       1.082500    
 C   -1.877400     -0.1803000      0.9453000    
 C    2.524000      0.3913000       1.054000    
 C   -2.703100      0.3879000     -0.2327000    
 C  -0.5450000       1.198800      -1.329300    
 C   0.3340000     -0.2391000       2.197100    
 C   -1.887000      0.5003000      -1.527700    
 C    1.724700      0.3617000       2.365900    
 C    2.597300       1.036500      -1.393500    
 C   -1.918500      -1.699600      0.7232000    
 C    2.952700      -1.036100      0.6534000    
 C    1.661700       2.642600      0.2527000    
 C   -3.738600     -0.7149000     -0.4150000    
 C    2.996700     -0.3833000      -1.775200    
 C   -3.357900      -1.981200      0.3079000    
 C    3.757200      -1.058700     -0.6414000    
 C   -3.378300       1.709100      0.1370000    
 H   0.4498000     -0.5361000     -0.5919000    
 H  -0.6393000       1.481900       1.406100    
 H   -2.416400      1.5000000E-02   1.885400    
 H    3.451000      0.9472000       1.257100    
 H  -2.9400000E-02   1.203200      -2.294300    
 H  -0.7240000       2.245300      -1.059900    
 H   0.4312000      -1.311500       1.998200    
 H  -0.2075000     -0.1519000       3.147200    
 H   -2.464900       1.037500      -2.290900    
 H   -1.701800     -0.4954000      -1.953000    
 H    1.631000       1.378300       2.765600    
 H    2.274100     -0.2081000       3.125500    
 H    3.521400       1.617700      -1.262100    
 H    2.079500       1.505800      -2.236300    
 H   -1.660000      -2.261300       1.626200    
 H   -1.231000      -2.010500     -7.1099997E-02
 H    3.555300      -1.480000       1.456800    
 H    2.087800      -1.701100      0.5464000    
 H    2.654500       3.052100      0.4746000    
 H    1.263400       3.220100     -0.5883000    
 H    1.030600       2.847300       1.120700    
 H    2.117800     -0.9769000      -2.053300    
 H    3.626800     -0.3632000      -2.673100    
 H   -4.007900      -2.100800       1.179300    
 H   -3.427200      -2.849600     -0.3507000    
 H    4.719800     -0.5549000     -0.4935000    
 H   -2.646300       2.483800      0.3854000    
 H   -3.995100       2.081600     -0.6887000    
 H   -4.043000       1.586400      0.9998000    
 H    4.526100      -2.810100     -0.2529000    


%chk=000011303-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000011303

0 1
O 4.089523 -2.441576 -1.073320
O -4.884397 -0.522160 -1.057383
C 0.322669 0.497143 -0.240701
C 1.754229 1.141251 -0.075949
C -0.466435 0.451480 1.106433
C -1.873453 -0.192764 0.962798
C 2.539626 0.398813 1.068661
C -2.739929 0.400729 -0.192444
C -0.549551 1.188337 -1.322049
C 0.344671 -0.233652 2.234031
C -1.899888 0.465047 -1.516968
C 1.745854 0.392806 2.400714
C 2.596427 1.033798 -1.390122
C -1.915295 -1.736090 0.721139
C 2.963991 -1.042041 0.663358
C 1.654319 2.655764 0.264366
C -3.812905 -0.687260 -0.424913
C 3.012225 -0.400775 -1.782638
C -3.358392 -2.002301 0.228202
C 3.787088 -1.062203 -0.638041
C -3.384619 1.766149 0.119205
H 0.473345 -0.552864 -0.572101
H -0.640453 1.505128 1.418752
H -2.415045 -0.001114 1.916281
H 3.476934 0.976935 1.232983
H -0.020522 1.206711 -2.293507
H -0.730441 2.243998 -1.040424
H 0.446011 -1.314176 2.014018
H -0.216798 -0.162344 3.187632
H -2.508693 0.969996 -2.290650
H -1.702049 -0.559848 -1.892548
H 1.643413 1.429914 2.776489
H 2.319761 -0.162644 3.169689
H 3.515734 1.640667 -1.245900
H 2.053038 1.508299 -2.228966
H -1.676809 -2.305677 1.635217
H -1.182409 -2.034071 -0.051434
H 3.555694 -1.483697 1.493253
H 2.084936 -1.696802 0.514007
H 2.652987 3.054990 0.525956
H 1.286685 3.233679 -0.603088
H 0.980678 2.863597 1.113204
H 2.131011 -1.027842 -2.017033
H 3.642141 -0.383165 -2.691259
H -4.041749 -2.199077 1.079301
H -3.469054 -2.851916 -0.467948
H 4.738896 -0.506295 -0.470464
H -2.636470 2.578529 0.130072
H -4.147787 2.003772 -0.643390
H -3.885333 1.753508 1.105216
H 4.572687 -2.906686 -0.343440


