%chk=000096169.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096169

0 1
 O  -0.5824000      -1.760200      0.6505000    
 O    3.230500       1.256100     -0.5068000    
 N   -1.812200      0.1001000      1.5799999E-02
 C   0.6692000      0.1654000     -4.7600001E-02
 C   -3.087700     -0.5576000      0.2724000    
 C   -1.909000       1.478200     -0.4599000    
 C  -0.6200000     -0.5973000      0.2399000    
 C    1.931400     -0.6540000      0.2181000    
 C   -3.598200      -1.277700     -0.9586000    
 C   -1.926600       2.462500      0.6915000    
 C    3.213700      8.5000001E-02 -0.1311000    
 C    4.491200     -0.7004000      1.5799999E-02
 H   0.6934000       1.072700      0.5638000    
 H   0.6661000      0.4616000      -1.102700    
 H   -2.959200      -1.285700       1.081300    
 H   -3.818500      0.1810000      0.6193000    
 H   -1.066300       1.708600      -1.116200    
 H   -2.814800       1.586800      -1.067000    
 H    1.979500     -0.9328000       1.276900    
 H    1.904800      -1.575500     -0.3750000    
 H   -3.759600     -0.5820000      -1.788300    
 H   -2.885400      -2.037400      -1.296500    
 H   -4.548600      -1.775100     -0.7423000    
 H   -2.793400       2.297000       1.339600    
 H   -1.031200       2.377100       1.314000    
 H   -1.980300       3.488000      0.3128000    
 H    4.604600      -1.024100       1.053400    
 H    5.344300     -7.1500003E-02 -0.2534000    
 H    4.467300      -1.566700     -0.6498000    


%chk=000096169-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096169

0 1
O -0.538415 -1.807043 0.344877
O 3.142263 0.454673 -1.554284
N -1.789799 0.120464 0.020662
C 0.707913 0.269196 -0.073954
C -3.042425 -0.658405 0.185886
C -1.922889 1.559996 -0.296193
C -0.578857 -0.551040 0.119703
C 1.950361 -0.535763 0.337261
C -3.561925 -1.232503 -1.149446
C -2.079473 2.451361 0.956638
C 3.197399 -0.202786 -0.478570
C 4.521571 -0.721970 0.069633
H 0.656717 1.222144 0.483471
H 0.818834 0.541629 -1.144065
H -2.829801 -1.485277 0.884118
H -3.799506 0.003499 0.647461
H -1.054138 1.888623 -0.890651
H -2.809011 1.679743 -0.948879
H 2.176954 -0.431634 1.415909
H 1.719203 -1.615342 0.200274
H -3.757930 -0.433177 -1.888173
H -2.819787 -1.929188 -1.574406
H -4.505166 -1.786238 -0.987958
H -2.956567 2.146090 1.555312
H -1.187910 2.386779 1.605549
H -2.217196 3.508317 0.662745
H 4.853206 -0.071020 0.902616
H 5.294520 -0.706340 -0.714513
H 4.414454 -1.742690 0.478881


