%chk=000010447.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010447

0 1
 O    4.791500     -0.7109000      0.2085000    
 O    3.864500       1.270300     -0.3996000    
 C   -2.685700     -0.1861000      0.2124000    
 C   -1.318700      0.4768000     -6.6699997E-02
 C  -0.1197000     -0.4245000      0.2478000    
 C   -3.801700      0.8515000     -3.3100002E-02
 C    1.203200      0.3010000     -2.5500000E-02
 C   -2.889700      -1.444000     -0.6377000    
 C    2.420900     -0.5846000      0.2410000    
 C   -5.201300      0.3346000      0.2696000    
 C    3.736600      0.1158000     -1.6500000E-02
 H   -2.716800     -0.4811000       1.269400    
 H   -1.271300      0.7867000      -1.118700    
 H   -1.236400       1.391600      0.5343000    
 H  -0.1587000     -0.7406000       1.296900    
 H  -0.1480000      -1.328200     -0.3694000    
 H   -3.617400       1.728900      0.5993000    
 H   -3.769300       1.199900      -1.072700    
 H    1.225800      0.6433000      -1.067900    
 H    1.263100       1.201200      0.5991000    
 H   -3.853300      -1.917800     -0.4284000    
 H   -2.129300      -2.201100     -0.4262000    
 H   -2.850600      -1.209200      -1.706600    
 H    2.378200      -1.468300     -0.4057000    
 H    2.413600     -0.9116000       1.286700    
 H   -5.921900       1.157400      0.2173000    
 H   -5.518900     -0.4212000     -0.4544000    
 H   -5.253800     -9.7099997E-02   1.273900    
 H    5.648100     -0.2661000      3.3000000E-02


%chk=000010447-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010447

0 1
O 4.857815 -0.716366 0.350350
O 3.960927 1.319300 -0.311637
C -2.704465 -0.206788 0.141436
C -1.328356 0.441574 -0.174333
C -0.099249 -0.434593 0.158303
C -3.836043 0.843367 -0.038469
C 1.234635 0.313859 -0.057857
C -2.954948 -1.468927 -0.719445
C 2.455105 -0.568857 0.263194
C -5.232752 0.376569 0.427276
C 3.779131 0.139831 0.060441
H -2.697327 -0.513135 1.211384
H -1.299895 0.720600 -1.249312
H -1.247053 1.391601 0.394667
H -0.168218 -0.773237 1.213869
H -0.106146 -1.350678 -0.466043
H -3.558541 1.757859 0.524998
H -3.881564 1.139690 -1.107570
H 1.301633 0.666690 -1.104976
H 1.262812 1.223678 0.571994
H -3.924589 -1.938965 -0.477071
H -2.172382 -2.232833 -0.563388
H -2.964128 -1.206805 -1.795851
H 2.462279 -1.483299 -0.362513
H 2.421935 -0.929105 1.310627
H -5.970679 1.196016 0.347089
H -5.608654 -0.466985 -0.179279
H -5.208727 0.048252 1.484047
H 5.710443 -0.221713 0.208170


