%chk=000028207.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028207

0 1
 O    2.885800      0.2853000      0.4983000    
 O   -3.426600       1.574800      7.0699997E-02
 N   -2.551100     -0.6028000     -0.1574000    
 N    1.965500      -2.332500      3.0400001E-02
 C    1.553100      5.1100001E-02  0.3348000    
 C   -1.182800     -0.3851000      6.6000000E-03
 C    1.075400      -1.238600      0.1022000    
 C  -0.2925000      -1.456700     -6.1999999E-02
 C   0.6628000       1.122600      0.4036000    
 C  -0.7051000      0.9045000      0.2395000    
 C    3.505900       1.172700     -0.4297000    
 C    4.959500      0.7816000     -0.5902000    
 C   -3.544500      0.3679000     -0.1132000    
 C   -4.905400     -0.2448000     -0.3336000    
 H  -0.6644000      -2.463100     -0.2434000    
 H    1.020100       2.131300      0.5934000    
 H   -1.319100       1.789900      0.3105000    
 H   -2.834300      -1.565900     -0.3238000    
 H    3.010800       1.128200      -1.407900    
 H    3.436700       2.195900     -4.4799998E-02
 H    1.612300      -3.264600     -0.1399000    
 H    2.958800      -2.179900      0.1447000    
 H    5.469800       1.450500      -1.288800    
 H    5.477100      0.8162000      0.3741000    
 H    5.043200     -0.2459000     -0.9594000    
 H   -4.944300     -0.7183000      -1.318700    
 H   -5.673700      0.5320000     -0.2837000    
 H   -5.107100     -0.9913000      0.4400000    


%chk=000028207-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028207

0 1
O 2.997369 -0.070798 -0.197930
O -3.506239 1.612057 -0.175987
N -2.641113 -0.570721 -0.064099
N 1.865928 -2.480255 -0.036771
C 1.582856 -0.072881 -0.172923
C -1.229883 -0.346270 -0.104297
C 1.010023 -1.383309 -0.085060
C -0.398319 -1.498902 -0.051830
C 0.756122 1.061743 -0.225006
C -0.654640 0.943285 -0.191755
C 3.670736 1.235739 -0.282993
C 5.173779 0.968439 -0.290093
C -3.679664 0.359155 -0.100333
C -5.072830 -0.276223 -0.042524
H -0.847669 -2.499291 0.015849
H 1.192571 2.062937 -0.292697
H -1.298185 1.821988 -0.232292
H -2.922758 -1.551979 -0.001730
H 3.348582 1.754212 -1.209664
H 3.376154 1.857323 0.587822
H 1.509436 -3.427307 0.031648
H 2.868245 -2.314799 -0.062709
H 5.727327 1.923133 -0.349333
H 5.481116 0.444092 0.631140
H 5.456546 0.347093 -1.157248
H -5.249280 -0.938541 -0.910677
H -5.822477 0.527840 -0.055281
H -5.207834 -0.872762 0.879073


