%chk=000014688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014688

0 1
 O   -4.580400      -1.598800      0.8639000    
 O   -5.265200       1.372300      0.8461000    
 O    4.859200      -2.079000      0.1346000    
 O    5.818000      0.5044000      0.4859000    
 C   -2.619300     -0.8489000     -0.4301000    
 C   -2.053200      0.5764000     -0.7335000    
 C  -0.6367000      0.8186000     -0.1554000    
 C   0.2617000     -0.4110000     -0.4114000    
 C   -4.077100     -0.5792000      1.7800000E-02
 C   -1.789600      -1.551800      0.6678000    
 C   -3.084600       1.571800     -0.1616000    
 C   -3.994100      0.7550000      0.7423000    
 C  -0.2902000      -1.628900      0.3609000    
 C   9.1000004E-03   2.071400     -0.7610000    
 C   -2.644300      -1.729000      -1.693700    
 C    1.740500     -0.1544000     -0.1500000    
 C    1.338000       2.359500     -7.0200004E-02
 C    2.241700       1.155400     -1.6300000E-02
 C    2.649400      -1.227600     -0.1165000    
 C    3.613000       1.357700      0.2127000    
 C    4.011500      -1.013200      9.7900003E-02
 C    4.492600      0.2792000      0.2700000    
 H   -2.009500      0.7298000      -1.820700    
 H  -0.7172000      0.9782000      0.9304000    
 H   0.2035000     -0.6392000      -1.485900    
 H   -4.753300     -0.5045000     -0.8435000    
 H   -2.163400      -2.567600      0.8490000    
 H   -1.912000      -1.018500       1.619500    
 H   -2.638900       2.406200      0.3893000    
 H   -3.657500       2.019700     -0.9840000    
 H   -3.583200      0.6500000       1.751800    
 H   0.2364000      -1.758700       1.315500    
 H  -8.8699996E-02  -2.538900     -0.2190000    
 H  -0.6425000       2.945500     -0.6550000    
 H   0.1719000       1.925300      -1.836900    
 H   -3.090300      -2.706800      -1.480400    
 H   -3.236800      -1.262600      -2.489100    
 H   -1.642500      -1.900800      -2.097700    
 H    1.153500       2.698000      0.9569000    
 H    1.837300       3.177300     -0.6036000    
 H   -5.454000      -1.310500       1.179200    
 H   -5.647200       1.441300     -4.5299999E-02
 H    2.291000      -2.244100     -0.2631000    
 H    3.996900       2.367800      0.3405000    
 H    4.349400      -2.895800     -2.9000000E-03
 H    6.277200     -0.3534000      0.4927000    


%chk=000014688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014688

0 1
O -4.632537 -1.687367 0.787743
O -5.386099 1.303850 0.982773
O 4.988873 -2.068050 0.147298
O 5.900798 0.464776 0.454706
C -2.626569 -0.868530 -0.461572
C -2.066615 0.596244 -0.753626
C -0.646666 0.834698 -0.167904
C 0.246108 -0.407025 -0.423498
C -4.091443 -0.596133 -0.017328
C -1.816958 -1.520208 0.693490
C -3.127854 1.603768 -0.186468
C -4.045699 0.754534 0.717472
C -0.303268 -1.636885 0.375025
C 0.013303 2.100294 -0.757504
C -2.613003 -1.777732 -1.712895
C 1.736204 -0.143064 -0.166816
C 1.348524 2.394537 -0.046929
C 2.259348 1.171366 -0.007149
C 2.635835 -1.243779 -0.120394
C 3.650088 1.357310 0.201220
C 4.008754 -1.044136 0.085011
C 4.529154 0.265147 0.251597
H -1.985481 0.723559 -1.852864
H -0.731674 0.981738 0.931758
H 0.142283 -0.637636 -1.508537
H -4.723880 -0.457021 -0.929573
H -2.241961 -2.513515 0.921629
H -1.949067 -0.918865 1.612931
H -2.667896 2.444873 0.360603
H -3.733709 2.041482 -1.006400
H -3.625669 0.623095 1.729611
H 0.253383 -1.730960 1.327038
H -0.110665 -2.566378 -0.195022
H -0.662930 2.972142 -0.661640
H 0.190311 1.944243 -1.841967
H -3.124851 -2.733538 -1.495369
H -3.139402 -1.294051 -2.558229
H -1.586362 -2.008229 -2.048383
H 1.138866 2.732983 0.989851
H 1.873925 3.232400 -0.543801
H -5.468626 -1.360763 1.210241
H -5.784489 1.591244 0.120544
H 2.250398 -2.263711 -0.247051
H 4.065261 2.363541 0.323256
H 4.589941 -2.962613 0.029402
H 6.352116 -0.420035 0.455619


