%chk=000130323.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130323

0 1
 O   -4.222900      0.7840000      0.3513000    
 O   -2.709900       2.270900     -0.2135000    
 N    2.441200      5.3300001E-02  0.4282000    
 N   -3.044600       1.089900      4.7200002E-02
 N    4.487500      0.7477000       1.256300    
 N    4.308400      0.5311000      -1.005500    
 C   0.2237000     -0.6195000     -0.3904000    
 C    1.631400     -0.2821000     -0.7496000    
 C  -0.7434000      0.3844000     -0.3398000    
 C  -0.1254000      -1.939200     -0.1040000    
 C   -2.059600      6.8599999E-02 -2.9000000E-03
 C   -1.441500      -2.255100      0.2330000    
 C   -2.408600      -1.251200      0.2835000    
 C    3.663800      0.4171000      0.2061000    
 H    2.077500      -1.133400      -1.281100    
 H    1.621400      0.5578000      -1.457400    
 H  -0.4476000       1.406800     -0.5646000    
 H   0.6190000      -2.730400     -0.1376000    
 H   -1.712800      -3.282800      0.4566000    
 H   -3.423800      -1.534400      0.5495000    
 H    4.154700      0.7130000       2.213800    
 H    5.448000       1.036300       1.106500    
 H    5.276700      0.8290000      -1.055700    
 H    3.850300      0.3214000      -1.885100    


%chk=000130323-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130323

0 1
O -4.594577 0.104702 -0.515770
O -3.275431 1.525834 -1.713667
N 2.649394 -0.467962 0.085516
N -3.437647 0.549875 -0.880795
N 4.886009 -0.639353 0.771149
N 4.341833 1.057853 -0.755157
C 0.199110 -0.220087 -0.167037
C 1.580350 0.289693 -0.579255
C -0.960578 0.383574 -0.702493
C 0.057487 -1.293013 0.746575
C -2.228976 -0.094665 -0.312829
C -1.224569 -1.758219 1.124132
C -2.388286 -1.163248 0.597899
C 3.884106 -0.023514 0.011293
H 1.647834 0.204323 -1.690544
H 1.625785 1.383237 -0.351235
H -0.904246 1.215423 -1.412437
H 0.975761 -1.738737 1.139113
H -1.315395 -2.589148 1.831704
H -3.392385 -1.498745 0.869088
H 4.567687 -1.387983 1.383522
H 5.837643 -0.690303 0.411963
H 5.209696 1.532887 -0.518562
H 3.722893 1.500777 -1.427369


