%chk=000161409.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161409

0 1
 O   -1.121700      -1.621000      0.4477000    
 O   -2.882300      0.3127000     -0.6145000    
 O    2.536000       1.330000      0.3125000    
 O   -5.114700      0.8827000     -0.4452000    
 O    4.305400       2.782000      0.2406000    
 C   -1.432200     -0.3960000       1.162700    
 C   -2.837300      4.8599999E-02  0.7908000    
 C  -0.3701000      0.6605000      0.8207000    
 C   0.7183000     -0.2351000      0.3730000    
 C   0.2139000      -1.506800      0.1583000    
 C   -3.226200       1.330000       1.532400    
 C   -3.853100      -1.059200       1.076900    
 C    2.046700      3.0500000E-02  0.1047000    
 C    1.000700      -2.537100     -0.3239000    
 C    2.877100     -0.9840000     -0.3712000    
 C    2.348800      -2.269700     -0.5851000    
 C   -4.090400      0.7238000      -1.095400    
 C    4.271100     -0.6707000     -0.6389000    
 C    3.865700       1.651500      6.0600001E-02
 C    4.732400      0.5659000     -0.4352000    
 C   -3.988000      0.9616000      -2.571500    
 H   -1.379400     -0.6364000       2.234800    
 H  -0.1022000       1.256100       1.698200    
 H  -0.6588000       1.324700      9.9999997E-05
 H   -4.302400       1.519400       1.572900    
 H   -2.903300       1.279000       2.579300    
 H   -2.763200       2.214400       1.080000    
 H   -3.809700      -1.850100      0.3188000    
 H   -4.892000     -0.7225000       1.127800    
 H   -3.652400      -1.518900       2.052300    
 H   0.5911000      -3.526800     -0.4934000    
 H    2.981600      -3.070700     -0.9604000    
 H    4.926000      -1.453500      -1.005100    
 H    5.771000      0.8075000     -0.6329000    
 H   -3.711800      3.3399999E-02  -3.077900    
 H   -3.250700       1.743500      -2.770400    
 H   -4.958000       1.292000      -2.953800    


%chk=000161409-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161409

0 1
O -1.133263 -1.698407 0.974659
O -2.664909 0.344385 -0.438251
O 2.389071 1.363838 0.189561
O -4.883624 0.901511 -0.965318
O 4.049727 2.937543 -0.138968
C -1.550128 -0.363056 1.560799
C -2.946015 0.021500 1.013246
C -0.392806 0.640804 1.246618
C 0.636203 -0.231969 0.562176
C 0.137498 -1.543288 0.426244
C -3.459011 1.279728 1.747030
C -3.929777 -1.159708 1.113172
C 1.907796 0.058329 0.056127
C 0.859929 -2.589797 -0.194091
C 2.685028 -0.966997 -0.579118
C 2.136986 -2.279676 -0.691014
C -3.687765 0.749295 -1.302241
C 3.990516 -0.602766 -1.073124
C 3.717809 1.749884 -0.309558
C 4.480639 0.681756 -0.945517
C -3.121215 0.970610 -2.689677
H -1.655102 -0.545197 2.646153
H 0.002659 1.110198 2.163456
H -0.734227 1.445502 0.573262
H -4.448093 1.565685 1.358325
H -3.555435 1.068685 2.827795
H -2.768712 2.131932 1.619897
H -3.561957 -2.014901 0.524338
H -4.925566 -0.860321 0.752846
H -4.014913 -1.482884 2.166854
H 0.432930 -3.591869 -0.276370
H 2.734846 -3.058956 -1.177398
H 4.601651 -1.371633 -1.560794
H 5.468533 0.965112 -1.316465
H -2.673797 0.035804 -3.069415
H -2.318252 1.727360 -2.658763
H -3.921352 1.303262 -3.366175


