%chk=000102808.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102808

0 1
 O    2.596600      0.1485000       2.259300    
 O  -0.5776000       2.386800      0.5908000    
 O  -0.2594000      -2.099000     -0.5242000    
 O    2.011100      -1.801200       1.275300    
 N   1.9400001E-02  0.1713000      5.1800001E-02
 C    1.454700      0.2555000      0.1283000    
 C    2.103000     -2.1199999E-02  -1.236600    
 C    3.614900      0.2636000      -1.384700    
 C  -0.8331000       1.236500      0.2866000    
 C  -0.6734000     -0.9843000     -0.2654000    
 C    3.882400       1.742400      -1.079300    
 C    4.497200     -0.6064000     -0.4923000    
 C   -2.187200      0.7191000      9.3400002E-02
 C   -2.090700     -0.6239000     -0.2404000    
 C    2.054300     -0.5758000       1.251400    
 C   -3.404600       1.359300      0.1997000    
 C   -3.206700      -1.397200     -0.4852000    
 C   -4.549500      0.5955000     -4.4799998E-02
 C   -4.451500     -0.7695000     -0.3837000    
 H    1.674800       1.299300      0.3823000    
 H    1.940700      -1.071800      -1.510800    
 H    1.573400      0.5657000      -2.000500    
 H    3.885200      6.8000004E-02  -2.430000    
 H    3.223600       2.391400      -1.665900    
 H    3.750100       1.981200     -1.9500000E-02
 H    4.915100       1.998400      -1.341500    
 H    4.506300     -0.2824000      0.5504000    
 H    4.198100      -1.658100     -0.5421000    
 H    5.536100     -0.5494000     -0.8382000    
 H   -3.480400       2.408300      0.4608000    
 H   -3.131800      -2.446500     -0.7454000    
 H   -5.530400       1.058200      2.7400000E-02
 H   -5.358200      -1.339800     -0.5682000    
 H    2.951100     -0.4240000       2.972500    


%chk=000102808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102808

0 1
O 2.490896 0.262361 2.298759
O -0.416057 2.254284 0.905468
O -0.265874 -2.052721 -1.035279
O 1.880420 -1.827531 1.489608
N 0.032608 0.102425 -0.017725
C 1.506123 0.205933 0.089620
C 2.222846 -0.241566 -1.213346
C 3.703539 0.212349 -1.363699
C -0.820480 1.165255 0.431515
C -0.725961 -0.999989 -0.536859
C 3.864163 1.752009 -1.326583
C 4.667123 -0.469869 -0.360941
C -2.218659 0.691561 0.198733
C -2.162963 -0.599431 -0.376662
C 1.959776 -0.594898 1.324227
C -3.442105 1.326372 0.462337
C -3.330287 -1.303310 -0.708323
C -4.629096 0.621994 0.133631
C -4.573828 -0.673114 -0.442734
H 1.702430 1.271886 0.297035
H 2.151631 -1.339685 -1.302901
H 1.642637 0.189261 -2.053203
H 3.997242 -0.126849 -2.379624
H 3.177243 2.248584 -2.037607
H 3.664983 2.159020 -0.317333
H 4.896960 2.040761 -1.595625
H 4.520987 -0.085265 0.665042
H 4.524958 -1.566021 -0.344394
H 5.717848 -0.266505 -0.639209
H -3.471122 2.326323 0.906200
H -3.274421 -2.302009 -1.152507
H -5.603878 1.082373 0.326945
H -5.506980 -1.192857 -0.684957
H 2.770900 -0.272632 3.091690


