%chk=000017898.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017898

0 1
 O   -1.835000      0.4442000     -1.9999999E-04
 N    1.792600      0.5448000      3.0000001E-04
 N  -0.3166000      -1.303900      1.9999999E-04
 C   0.5023000      0.9344000      6.0000003E-04
 C  -0.5337000      2.6400000E-02  6.0000003E-04
 C   0.2436000       2.401900     -6.0000003E-04
 C    2.009600     -0.7855000     -3.0000001E-04
 C   0.9735000      -1.693500     -5.0000002E-04
 C   -2.836200     -0.5686000     -1.9999999E-04
 H  -0.3226000       2.691500      0.8903000    
 H    1.182100       2.966100      6.0000003E-04
 H  -0.3197000       2.690500     -0.8938000    
 H    3.046000      -1.099400     -6.9999998E-04
 H    1.148700      -2.762200     -8.9999998E-04
 H   -2.769200      -1.186200     -0.9020000    
 H   -3.812900     -7.5599998E-02 -3.9999999E-04
 H   -2.769600      -1.186000      0.9019000    


%chk=000017898-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017898

0 1
O -1.824585 0.451654 -0.000324
N 1.823097 0.545991 -0.000314
N -0.291805 -1.355495 -0.000184
C 0.526974 0.961270 -0.000368
C -0.524184 -0.021640 -0.000277
C 0.227684 2.436469 -0.000558
C 2.068256 -0.805401 -0.000232
C 1.020196 -1.747412 -0.000168
C -2.902384 -0.558075 -0.000127
H -0.373669 2.718482 0.883508
H 1.174386 2.998593 0.000849
H -0.370994 2.718803 -0.886363
H 3.117688 -1.114232 -0.000185
H 1.213662 -2.825053 -0.000101
H -2.835652 -1.198492 -0.896507
H -3.830461 0.031966 0.000051
H -2.835309 -1.198526 0.896199


