%chk=000020960.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020960

0 1
 O   0.6394000     -0.7462000      0.6891000    
 O    1.948100      -1.379300      -1.106300    
 C   0.2934000      0.4689000      1.5400000E-02
 C    1.588400       1.245500     -0.2274000    
 C  -0.4038000      0.1298000      -1.308700    
 C  -0.6492000       1.268100      0.9325000    
 C   -1.702900     -0.6550000      -1.088400    
 C   -2.545300     -0.1239000      4.2900000E-02
 C   -2.062100      0.7541000      0.9384000    
 C    1.293700       2.571100     -0.9237000    
 C    2.325600       1.479600       1.088200    
 C   -3.953600     -0.6358000      0.1148000    
 C    1.477400      -1.576900      5.7000001E-03
 C    1.750900      -2.799900      0.8275000    
 H    2.288700      0.7310000     -0.8875000    
 H   0.2071000     -0.4027000      -2.040000    
 H  -0.7027000       1.056400      -1.814800    
 H  -0.7273000       2.323600      0.6658000    
 H  -0.2942000       1.213500       1.969200    
 H   -1.468700      -1.707400     -0.8868000    
 H   -2.281200     -0.6305000      -2.020300    
 H   -2.707500       1.126900       1.729900    
 H    2.244700       3.075900      -1.139400    
 H   0.8029000       2.452700      -1.892100    
 H   0.7249000       3.279300     -0.3172000    
 H    1.771700       2.133700       1.768900    
 H    3.284400       1.974700      0.8930000    
 H    2.555300      0.5483000       1.614300    
 H   -4.500500     -0.2230000      0.9689000    
 H   -3.955500      -1.726200      0.2135000    
 H   -4.502400     -0.3675000     -0.7937000    
 H   0.8162000      -3.331500       1.022500    
 H    2.235600      -2.515400       1.764800    
 H    2.421600      -3.464900      0.2760000    


%chk=000020960-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020960

0 1
O 0.666480 -0.752107 0.638716
O 1.857564 -1.643825 -1.181506
C 0.303319 0.577082 -0.037478
C 1.631003 1.375287 -0.256252
C -0.465929 0.295863 -1.349524
C -0.639550 1.215579 1.005987
C -1.675978 -0.635478 -1.125616
C -2.538470 -0.198174 0.049528
C -2.049288 0.651335 0.993114
C 1.406885 2.700681 -1.027891
C 2.380464 1.646676 1.070950
C -3.940125 -0.771472 0.116716
C 1.407659 -1.731058 -0.012779
C 1.595579 -2.923958 0.907346
H 2.269541 0.729881 -0.889896
H 0.216196 -0.121334 -2.108796
H -0.836520 1.271052 -1.719062
H -0.672182 2.311596 0.837167
H -0.195844 1.073900 2.009904
H -1.332332 -1.678422 -0.961991
H -2.289304 -0.665549 -2.048821
H -2.696582 0.954601 1.828965
H 2.372866 3.224970 -1.147080
H 0.995192 2.529487 -2.037601
H 0.725198 3.384400 -0.486921
H 1.849071 2.390253 1.693856
H 3.387646 2.050455 0.860537
H 2.498632 0.723824 1.665680
H -4.482600 -0.428296 1.015008
H -3.914684 -1.879754 0.136056
H -4.534057 -0.485976 -0.774546
H 0.614704 -3.322334 1.219760
H 2.129394 -2.617035 1.823773
H 2.169155 -3.705151 0.387696


