%chk=000018988.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018988

0 1
 O  -0.8932000       1.855700     -0.1658000    
 O    2.600200      -1.056700     -0.3520000    
 N   -1.417500     -0.3706000      9.8399997E-02
 N   0.8636000      0.3857000      2.5599999E-02
 N    1.374900     -0.9335000     -0.4531000    
 C  -0.5040000      0.6890000     -1.8999999E-02
 C   -2.730700     -0.3459000     -0.5432000    
 C   -1.123100      -1.572000      0.8681000    
 C    1.829900       1.348300      0.5409000    
 H   -3.502800     -0.3514000      0.2311000    
 H   -2.832000      -1.230700      -1.177900    
 H   -2.840300      0.5518000      -1.157400    
 H  -0.2703000      -1.426600       1.536100    
 H  -0.9377000      -2.402400      0.1810000    
 H   -1.992000      -1.813300       1.489100    
 H    1.324100       2.243300      0.9140000    
 H    2.512800       1.635400     -0.2641000    
 H    2.388000      0.8951000       1.365700    


%chk=000018988-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018988

0 1
O -0.826951 1.772653 -0.435314
O 2.694842 -1.017728 -0.087969
N -1.383692 -0.444876 0.062233
N 0.910899 0.320708 0.170119
N 1.421583 -0.940033 -0.191820
C -0.496222 0.598807 -0.089550
C -2.769423 -0.231790 -0.402471
C -1.122769 -1.741483 0.719836
C 1.825323 1.433021 0.501514
H -3.465486 -0.182041 0.456579
H -3.074588 -1.065557 -1.060917
H -2.822569 0.716963 -0.955350
H -0.299114 -1.660270 1.443847
H -0.861602 -2.527402 -0.009671
H -2.038243 -2.039566 1.262792
H 1.228023 2.353233 0.547317
H 2.602329 1.523358 -0.277270
H 2.327561 1.233202 1.463593


