%chk=000118015.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118015

0 1
 O   4.2599998E-02 -0.1562000      -1.320200    
 O   0.8397000      -2.296100       1.284500    
 N   -2.144900      0.3657000     -0.9952000    
 N  -0.9691000      -1.116800      0.4500000    
 C   -3.426600      0.3388000     -0.3149000    
 C    1.050500     -0.9970000     -0.7458000    
 C   -1.079100     -0.3267000     -0.5647000    
 C    2.232800     -0.1800000     -0.3725000    
 C   -3.942000      -1.103200     -0.2910000    
 C   -4.400400       1.236400      -1.082500    
 C   0.3281000      -1.560900      0.4506000    
 C    2.097800       1.194000     -0.1511000    
 C    3.489400     -0.7789000     -0.2403000    
 C   -3.260800      0.8343000       1.065100    
 C    3.208700       1.961500      0.1992000    
 C    4.600200     -1.1400000E-02  0.1103000    
 C    4.459800       1.358800      0.3300000    
 C   -3.126700       1.237500       2.188500    
 H    1.287100      -1.788500      -1.463900    
 H   -2.055900      0.9485000      -1.822800    
 H   -3.943300      -1.541600      -1.296200    
 H   -3.361600      -1.765800      0.3587000    
 H   -4.972700      -1.139400      8.3700001E-02
 H   -5.387600       1.256800     -0.6058000    
 H   -4.038700       2.271100      -1.129800    
 H   -4.532400      0.8895000      -2.114200    
 H    1.138400       1.697200     -0.2309000    
 H    3.611700      -1.846000     -0.4081000    
 H    3.099300       3.028000      0.3733000    
 H    5.574300     -0.4808000      0.2125000    
 H    5.324400       1.956400      0.6038000    
 H   -3.007000       1.594700       3.184500    


%chk=000118015-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118015

0 1
O 0.040756 -0.158806 -1.466142
O 0.912441 -2.576534 1.064167
N -2.194334 0.288357 -1.033198
N -0.957717 -1.255790 0.362373
C -3.502288 0.328119 -0.298050
C 1.126949 -0.993310 -0.868139
C -1.093769 -0.401023 -0.650039
C 2.302355 -0.148198 -0.429076
C -4.044434 -1.108911 -0.069914
C -4.477134 1.139142 -1.195323
C 0.381373 -1.726303 0.320626
C 2.121858 1.171946 0.051739
C 3.600570 -0.713911 -0.444096
C -3.326788 1.027158 1.003913
C 3.230186 1.917607 0.507766
C 4.706893 0.030552 0.021334
C 4.525698 1.349587 0.496541
C -3.207873 1.619698 2.077025
H 1.424782 -1.742223 -1.622051
H -2.069073 0.938510 -1.812961
H -4.203807 -1.605650 -1.043596
H -3.329958 -1.696570 0.526561
H -5.006673 -1.055235 0.467056
H -5.459065 1.211487 -0.701582
H -4.106934 2.166536 -1.365674
H -4.609958 0.630176 -2.166982
H 1.121530 1.617729 0.057099
H 3.744745 -1.738419 -0.806676
H 3.083833 2.939936 0.873946
H 5.706823 -0.416854 0.010018
H 5.384372 1.929158 0.853136
H -3.089359 2.111939 3.025001


