%chk=000164158.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164158

0 1
 O  -0.5088000       1.033900     -0.6711000    
 O    4.986200      -1.510900       1.048900    
 N   -2.218100       2.015600      0.5132000    
 N   -4.201800      0.7663000       1.070700    
 C    1.481700       2.263500      -1.254500    
 C    2.419500       1.254000     -0.6382000    
 C   0.1280000       2.300400     -0.5540000    
 C   -2.441300     -0.2934000     -0.1656000    
 C    3.255500       1.645300      0.3956000    
 C    2.426900     -4.6399999E-02  -1.117200    
 C   -1.747900      0.9117000     -9.7599998E-02
 C   -3.702300     -0.3179000      0.4521000    
 C    4.121700      0.7119000      0.9651000    
 C    3.292800     -0.9799000     -0.5476000    
 C    4.140300     -0.6007000      0.4935000    
 C   -1.929100      -1.433100     -0.8096000    
 C   -4.426300      -1.506700      0.4048000    
 C   -2.674000      -2.607900     -0.8417000    
 C   -3.923900      -2.644400     -0.2337000    
 C   -3.432900       1.874100       1.067700    
 C    4.953900      -2.835300      0.5191000    
 H    1.342400       2.016400      -2.315000    
 H    1.940700       3.259500      -1.229300    
 H  -0.4872000       3.073100      -1.032100    
 H   0.2688000       2.554200      0.5046000    
 H    3.246400       2.664700      0.7708000    
 H    1.770900     -0.3516000      -1.927500    
 H    4.779100       1.013000       1.776000    
 H    3.255700      -1.981700     -0.9617000    
 H  -0.9535000      -1.419800      -1.288900    
 H   -5.407400      -1.561600      0.8730000    
 H   -2.281700      -3.490200      -1.338000    
 H   -4.511900      -3.557400     -0.2542000    
 H   -3.840900       2.744000       1.567600    
 H    5.688600      -3.424800       1.077300    
 H    5.260100      -2.855500     -0.5323000    
 H    3.978500      -3.308100      0.6765000    


%chk=000164158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000164158

0 1
O -0.607070 1.101975 -0.715642
O 5.174571 -1.441372 1.098907
N -2.274645 1.996190 0.691472
N -4.265969 0.697359 1.261158
C 1.451170 2.239768 -1.334343
C 2.433163 1.245682 -0.730909
C 0.141834 2.382381 -0.543243
C -2.517352 -0.268902 -0.215917
C 3.388864 1.665102 0.233800
C 2.408811 -0.122833 -1.087279
C -1.807924 0.980899 -0.056139
C -3.778097 -0.358509 0.482988
C 4.282815 0.753333 0.824425
C 3.298589 -1.056587 -0.507901
C 4.239350 -0.614218 0.454672
C -2.049427 -1.366581 -0.996022
C -4.543782 -1.558899 0.376211
C -2.820082 -2.532054 -1.083846
C -4.070135 -2.625876 -0.395838
C -3.495229 1.793571 1.318493
C 5.165433 -2.864550 0.756895
H 1.198026 1.960064 -2.373968
H 1.910356 3.246827 -1.374862
H -0.489103 3.204225 -0.927842
H 0.314803 2.547282 0.534669
H 3.437664 2.722297 0.523987
H 1.678412 -0.469150 -1.827890
H 5.022070 1.073279 1.565123
H 3.249441 -2.107119 -0.810037
H -1.089797 -1.278370 -1.513908
H -5.495874 -1.607698 0.912907
H -2.467275 -3.379291 -1.681803
H -4.661120 -3.545038 -0.475190
H -3.856398 2.631438 1.923094
H 5.956588 -3.313839 1.375016
H 5.394747 -3.024266 -0.315125
H 4.191272 -3.332223 1.000582


