%chk=000104121.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104121

0 1
 O  -0.3139000       1.708300     -0.3233000    
 O   -2.978700       1.029200     -2.3200000E-02
 O    2.565700      -1.874200     -9.8099999E-02
 N    1.186900     -5.4400001E-02 -0.2199000    
 N   -1.143300     -0.4226000      1.5000000E-02
 N    1.382200      -1.522600     -4.6900000E-02
 C    2.363200      0.7822000     -0.4223000    
 C    2.899100       1.261900      0.9129000    
 C  -0.1048000      0.4990000     -0.1857000    
 C   -2.498400     -9.5899999E-02  8.1900001E-02
 C   -3.358000      -1.311000      0.3096000    
 H    3.129600      0.2466000     -0.9922000    
 H    2.076200       1.653400      -1.022400    
 H    2.142200       1.830700       1.463400    
 H    3.207800      0.4216000       1.543300    
 H    3.767800       1.910200      0.7623000    
 H  -0.9097000      -1.404200      0.1225000    
 H   -3.211400      -2.027600     -0.5034000    
 H   -4.411100      -1.018100      0.3383000    
 H   -3.093000      -1.778800       1.261900    


%chk=000104121-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104121

0 1
O -0.251673 1.815473 -0.350723
O -3.062759 1.033678 -0.018267
O 2.397539 -1.935385 -0.062872
N 1.178716 -0.040811 -0.236200
N -1.157479 -0.360347 -0.007800
N 1.226427 -1.430140 -0.056138
C 2.392465 0.792322 -0.411663
C 2.968130 1.274505 0.936908
C -0.142243 0.581514 -0.206218
C -2.557936 -0.105667 0.077723
C -3.361377 -1.382806 0.308558
H 3.127646 0.168537 -0.948790
H 2.101506 1.649741 -1.038666
H 2.234463 1.897915 1.475173
H 3.258923 0.423382 1.575787
H 3.867785 1.887024 0.750442
H -0.823964 -1.330263 0.084728
H -3.201150 -2.108332 -0.510118
H -4.428985 -1.126586 0.355233
H -3.067633 -1.870055 1.256605


