%chk=000176421.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176421

0 1
 I    2.023100       2.836200       0.000000    
 O    2.832300     -0.3122000     -9.9999997E-05
 N    1.263100      -2.607500       0.000000    
 N   -3.888600      0.2709000       0.000000    
 C   0.6777000      -1.322300       0.000000    
 C    1.473600     -0.1766000       0.000000    
 C  -0.7123000      -1.205900       0.000000    
 C   -1.306600      5.6000002E-02   0.000000    
 C   0.8792000       1.085400       0.000000    
 C  -0.5109000       1.201500       0.000000    
 C   -2.730700      0.1745000       0.000000    
 H   -1.331700      -2.101000       0.000000    
 H  -0.9828000       2.182400     -9.9999997E-05
 H   0.6780000      -3.432300      9.9999997E-05
 H    2.270200      -2.700900      1.9999999E-04
 H    3.228200      0.5764000     -9.9999997E-05


%chk=000176421-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176421

0 1
I 2.103831 2.851922 -0.000071
O 2.842103 -0.396063 -0.000006
N 1.310036 -2.580069 0.000039
N -3.977013 0.277396 -0.000001
C 0.660310 -1.356262 0.000017
C 1.463081 -0.166783 -0.000005
C -0.747667 -1.220932 0.000016
C -1.350296 0.065056 -0.000008
C 0.845537 1.100476 -0.000033
C -0.555789 1.243211 -0.000035
C -2.783952 0.181855 -0.000009
H -1.380096 -2.114169 0.000037
H -1.028055 2.227078 -0.000058
H 0.788958 -3.451213 0.000087
H 2.326703 -2.600144 0.000053
H 3.344108 0.463240 -0.000022


