%chk=000117032.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117032

0 1
 O  -0.3763000       2.328400      4.3099999E-02
 O    2.077300      -2.384000     -5.1500000E-02
 N   -1.958700      0.1694000     -3.5000001E-03
 C  -0.6043000     -2.4200000E-02 -5.1000002E-03
 C   2.5100000E-02  -1.210800     -2.3700001E-02
 C   -2.793700     -0.3215000      -1.089800    
 C   -2.654000      0.6463000       1.182900    
 C   0.1921000       1.237200      1.6799999E-02
 C    1.682000       1.161300      1.3000000E-02
 C    2.303900     -2.9200001E-02  1.0200000E-02
 C    1.512800      -1.292000     -2.1900000E-02
 C  -0.6731000      -2.545100     -4.7800001E-02
 C   -2.406700      0.3186000      -2.412200    
 C   -2.495100     -0.3254000       2.340000    
 C    2.373200       2.498700     -4.0000002E-03
 C    3.795500     -0.2277000      5.3599998E-02
 H   -2.750600      -1.409400      -1.185700    
 H   -3.849900     -8.7200001E-02 -0.9095000    
 H   -2.269700       1.626200       1.487100    
 H   -3.722600      0.7985000      0.9913000    
 H  -0.1591000      -3.268000      0.5959000    
 H  -0.6919000      -2.945800      -1.066200    
 H   -1.695300      -2.499100      0.3345000    
 H   -2.449400       1.411100      -2.348300    
 H   -1.393300      3.7400000E-02  -2.716900    
 H   -3.092500     -2.6000000E-03  -3.202800    
 H   -2.886000      -1.314700       2.081700    
 H   -1.448200     -0.4384000       2.639000    
 H   -3.049900      3.6800001E-02   3.211700    
 H    3.433100       2.438400     -0.2600000    
 H    2.284900       2.981200      0.9749000    
 H    1.921200       3.156200     -0.7553000    
 H    4.160200     -0.5601000     -0.9238000    
 H    4.061500     -0.9867000      0.7980000    
 H    4.346700      0.6720000      0.3356000    


%chk=000117032-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117032

0 1
O -0.282494 2.392258 0.332188
O 2.256136 -2.338525 -0.554566
N -1.887844 0.090136 0.184768
C -0.493117 -0.021301 0.118314
C 0.167766 -1.222935 -0.152286
C -2.780360 -0.566954 -0.807665
C -2.566863 0.912104 1.220791
C 0.307461 1.266233 0.227880
C 1.795088 1.214344 0.129065
C 2.426772 0.031372 -0.181675
C 1.632114 -1.237736 -0.331723
C -0.523691 -2.568547 -0.165385
C -2.340381 -0.323039 -2.265163
C -3.374454 0.035212 2.206299
C 2.547466 2.510821 0.335200
C 3.923384 -0.065508 -0.357335
H -2.883022 -1.653750 -0.624324
H -3.782929 -0.126714 -0.655390
H -1.809499 1.490418 1.767297
H -3.231576 1.649451 0.728746
H 0.233184 -3.359486 -0.042772
H -1.050810 -2.775163 -1.118166
H -1.266350 -2.635657 0.650280
H -2.293311 0.758196 -2.483254
H -1.347133 -0.758716 -2.468843
H -3.066145 -0.789570 -2.956165
H -4.163915 -0.544267 1.694118
H -2.709849 -0.674759 2.730082
H -3.864069 0.676513 2.962573
H 3.245225 2.706200 -0.499915
H 3.156522 2.475101 1.259515
H 1.841999 3.352162 0.415039
H 4.261826 0.537260 -1.222768
H 4.214646 -1.114009 -0.522950
H 4.457425 0.324654 0.529489


