%chk=000146665.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146665

0 1
 O   -3.037500       2.122800      0.1101000    
 O   -3.076100      -3.351700     -0.2903000    
 O   -5.095700      -2.221800      0.3806000    
 O   -2.045700       4.153500     -0.1874000    
 O   0.7130000       3.545800      -1.319200    
 O    2.614300      -1.243600       2.513900    
 O    3.790600     -0.8699000      -2.113800    
 O    4.408300      -1.704000      0.4545000    
 C  -0.5042000      0.9311000     -0.5818000    
 C  -0.5966000       2.253600      0.2095000    
 C   -1.730800      8.1500001E-02 -0.3052000    
 C   0.8191000      0.2214000     -0.3026000    
 C   -2.934200      0.7170000      5.6400001E-02
 C   -1.926600       2.945600     -8.7000001E-03
 C   -1.738200      -1.315500     -0.4610000    
 C   0.5475000       3.157800     -0.1637000    
 C   -2.909200      -2.003400     -0.2000000    
 C   -4.112900      9.3000000E-03  0.3131000    
 C    1.710900     -3.8000001E-03  -1.344300    
 C    1.117800     -0.1919000      0.9901000    
 C   -4.062100      -1.359800      0.1821000    
 C    2.326200     -0.8402000       1.245000    
 C    2.919500     -0.6521000      -1.089400    
 C    1.477400       3.565900      0.9466000    
 C    3.227000      -1.070400      0.2052000    
 C   -4.462300      -3.483300      8.5400000E-02
 C    3.304100     -0.3150000       3.348300    
 C    3.653200      -2.094300      -2.832200    
 C    5.603200     -0.9848000      0.1589000    
 H  -0.5517000       1.167200      -1.655600    
 H  -0.5430000       2.069100       1.291300    
 H  -0.8560000      -1.860500     -0.7795000    
 H    1.478100      0.3206000      -2.355100    
 H   0.4219000     -2.4000000E-02   1.807800    
 H   -5.030400      0.5174000      0.5874000    
 H   0.9142000       4.092400       1.721200    
 H    1.968200       2.686800       1.368800    
 H    2.243800       4.239500      0.5528000    
 H   -5.004400      -3.964100     -0.7369000    
 H   -4.526400      -4.124500      0.9721000    
 H    3.461200     -0.7824000       4.324200    
 H    2.707300      0.5923000       3.486700    
 H    4.279000     -6.1200000E-02   2.920800    
 H    2.671900      -2.147500      -3.314100    
 H    3.791200      -2.951000      -2.164900    
 H    4.425400      -2.126000      -3.605700    
 H    6.356200      -1.264100      0.9016000    
 H    5.458400      0.1001000      0.2119000    
 H    5.979200      -1.271000     -0.8273000    


%chk=000146665-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146665

0 1
O -3.126539 2.204141 -0.011454
O -3.091828 -3.372606 0.082334
O -5.141383 -2.226809 0.587661
O -2.204952 4.283258 -0.016909
O 0.705666 3.251856 -1.824006
O 2.620396 -0.969261 2.609505
O 3.903589 -0.616533 -2.166061
O 4.601009 -1.383587 0.536216
C -0.553112 0.989706 -0.654022
C -0.619295 2.388720 0.035275
C -1.762752 0.143612 -0.260210
C 0.792699 0.323480 -0.353201
C -2.989035 0.782574 0.034589
C -2.005567 3.055444 -0.009101
C -1.721927 -1.280428 -0.256033
C 0.402351 3.374416 -0.612381
C -2.894327 -1.967829 0.052358
C -4.187040 0.092347 0.345005
C 1.733114 0.113450 -1.386443
C 1.108466 -0.095311 0.962301
C -4.102174 -1.298042 0.347552
C 2.360294 -0.677869 1.259026
C 2.980059 -0.485235 -1.105384
C 0.974509 4.450949 0.281780
C 3.325540 -0.852455 0.225714
C -4.474932 -3.559317 0.594626
C 3.109721 -2.330100 2.927224
C 4.342515 -2.001479 -2.458596
C 5.700984 -0.392129 0.415838
H -0.595623 1.181096 -1.745791
H -0.370261 2.282426 1.111317
H -0.794283 -1.810214 -0.483392
H 1.524226 0.424177 -2.414491
H 0.390654 0.007886 1.783298
H -5.107769 0.638005 0.557533
H 0.147578 5.053815 0.700566
H 1.515156 3.991661 1.131849
H 1.659445 5.099339 -0.285160
H -5.020616 -4.234534 -0.082193
H -4.428906 -3.930380 1.635437
H 3.256644 -2.330988 4.017891
H 4.056443 -2.540685 2.403831
H 2.344623 -3.081087 2.650826
H 3.482020 -2.605088 -2.804403
H 4.799201 -2.468866 -1.568403
H 5.081008 -1.905699 -3.268819
H 6.622246 -0.945076 0.654559
H 5.550620 0.427774 1.141786
H 5.745644 0.010372 -0.611845


