%chk=000123646.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123646

0 1
 O   0.7946000     -0.7209000     -3.6800001E-02
 O  -0.4463000       1.242400     -0.2700000    
 O    4.328800       1.431400      2.9899999E-02
 O    3.186900     -0.6186000       1.520600    
 O    1.917100       2.618300      -1.037900    
 O   0.6538000      -3.456900     -0.2219000    
 O   -3.040300      0.2345000       2.712200    
 O   -1.127400       1.128400       2.096300    
 N   -2.213100      0.5619000       1.829700    
 C    3.250400      0.6787000     -0.5187000    
 C    3.219300     -0.7212000      9.5600002E-02
 C    1.938600       1.419900     -0.2626000    
 C    1.968400      -1.468200     -0.3797000    
 C   0.7410000      0.5577000     -0.6681000    
 C    1.835500      -2.844200      0.2621000    
 C   -1.633000      0.6219000     -0.5486000    
 C   -2.518200      0.2785000      0.4701000    
 C   -1.945000      0.3386000      -1.876100    
 C   -3.722900     -0.3524000      0.1596000    
 C   -3.149700     -0.2922000      -2.186700    
 C   -4.038700     -0.6377000      -1.168900    
 H    3.430900      0.6028000      -1.598300    
 H    4.132300      -1.268000     -0.1627000    
 H    1.868400       1.724100      0.7887000    
 H    1.982800      -1.588500      -1.471000    
 H   0.7416000      0.4328000      -1.758800    
 H    1.747400      -2.782400       1.351500    
 H    2.688100      -3.482700      1.2800000E-02
 H    4.300400       2.316600     -0.3718000    
 H    2.317100     -0.2726000       1.782300    
 H    1.062800       3.054100     -0.8759000    
 H  -9.1899998E-02  -2.872300     -2.3000001E-03
 H   -1.277600      0.6178000      -2.686100    
 H   -4.441800     -0.6374000      0.9235000    
 H   -3.398000     -0.5100000      -3.221300    
 H   -4.977100      -1.127700      -1.411400    


%chk=000123646-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123646

0 1
O 1.125904 -1.304961 -0.065673
O -0.532541 0.269634 0.548989
O 4.078744 1.716441 0.242156
O 3.730219 -1.045800 1.218517
O 1.306473 2.446368 -0.012721
O 1.549913 -3.795524 -1.277548
O -3.551016 2.630306 1.850059
O -1.423994 2.807587 1.078564
N -2.569926 2.207256 1.129515
C 3.069593 0.842196 -0.327629
C 3.500923 -0.636762 -0.168304
C 1.693200 1.081751 0.320250
C 2.410221 -1.524660 -0.820081
C 0.670275 0.079798 -0.239171
C 2.676016 -3.030985 -0.734908
C -1.775598 0.113650 -0.067765
C -2.815634 1.017285 0.283567
C -2.059760 -0.955216 -0.948372
C -4.132142 0.826132 -0.196134
C -3.363802 -1.119140 -1.459101
C -4.404853 -0.238150 -1.075614
H 2.955802 1.045227 -1.419409
H 4.476248 -0.783502 -0.663380
H 1.754949 0.941994 1.420009
H 2.244579 -1.234085 -1.879757
H 0.461293 0.278824 -1.314560
H 2.900482 -3.313412 0.312080
H 3.542267 -3.290514 -1.365543
H 3.699330 2.634524 0.246239
H 2.851857 -1.077662 1.681648
H 0.428353 2.654077 0.414448
H 0.754553 -3.568618 -0.730286
H -1.263124 -1.664016 -1.195317
H -4.912245 1.525384 0.117135
H -3.572734 -1.949351 -2.141588
H -5.418627 -0.379578 -1.461018


