%chk=000021627.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021627

0 1
 O   -1.957900      -2.616300      0.6863000    
 O  -0.5540000      -2.194900      -1.051000    
 N   0.3297000      0.4280000     -0.8801000    
 N    1.133000      0.3745000      7.7100001E-02
 N    3.932500       2.206300      0.3747000    
 N    3.275200      -2.140000      0.6838000    
 C   -1.807800     -0.4069000     -7.3899999E-02
 C  -0.9669000      0.6567000     -0.4018000    
 C   -3.095300     -0.1571000      0.4011000    
 C   -1.413700       1.970000     -0.2548000    
 C   -3.542000       1.156200      0.5480000    
 C   -2.701200       2.219700      0.2202000    
 C   -1.367700      -1.788400     -0.2174000    
 C    2.503000      0.1353000     -0.3751000    
 C    3.299900       1.290600      4.5299999E-02
 C    2.933200      -1.133700      0.2177000    
 H   -3.779400     -0.9632000      0.6526000    
 H  -0.7671000       2.806100     -0.5083000    
 H   -4.545500       1.351000      0.9148000    
 H   -3.049400       3.242100      0.3338000    
 H    2.560000      4.8599999E-02  -1.468700    
 H   -1.656100      -3.544100      0.5832000    


%chk=000021627-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021627

0 1
O -2.825697 -2.698118 -0.624388
O -0.569471 -2.538609 -0.098003
N 0.394693 -0.001506 -0.320680
N 1.359117 0.576370 0.316020
N 3.686117 2.173145 -1.695470
N 4.311068 -0.674078 1.677457
C -1.986134 -0.539602 -0.010118
C -0.924796 0.413831 0.064182
C -3.316768 -0.106296 0.204605
C -1.204410 1.769683 0.372466
C -3.592121 1.245080 0.504551
C -2.533782 2.180350 0.594354
C -1.682813 -1.979659 -0.236435
C 2.704784 0.121120 -0.298359
C 3.270174 1.253297 -1.062276
C 3.602780 -0.305857 0.793618
H -4.122064 -0.842893 0.145360
H -0.374928 2.483014 0.406943
H -4.625070 1.567421 0.669481
H -2.746266 3.228512 0.829340
H 2.517927 -0.729342 -0.987520
H -2.579838 -3.655361 -0.737628


