%chk=000005579.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005579

1 1
 N   -1.803900     -0.1993000       0.000000    
 N    2.884700      -1.590600      3.9999999E-04
 C  -0.3140000      0.1515000     -3.9999999E-04
 C   -2.447600      0.3924000      -1.250800    
 C   -2.442800      0.3732000       1.262200    
 C   -2.042000      -1.707800     -1.0500000E-02
 C   0.5599000     -0.8836000     -8.9999998E-04
 C   5.5999998E-03   1.467900      1.9999999E-04
 C    1.917600     -0.5636000     -6.9999998E-04
 C    1.363200       1.787800      5.0000002E-04
 C    2.319200      0.7722000      9.9999997E-05
 H   -1.912500      2.0099999E-02  -2.130400    
 H   -3.492400      6.6500001E-02  -1.281400    
 H   -2.417900       1.484400      -1.205900    
 H   -2.407900       1.465700       1.235700    
 H   -3.488800      5.0999999E-02   1.289400    
 H   -1.906900     -1.5799999E-02   2.133900    
 H   -1.630000      -2.152600      0.9013000    
 H   -3.125500      -1.873500     -1.2900000E-02
 H   -1.627300      -2.140000     -0.9272000    
 H   0.3060000      -1.934600     -6.9999998E-04
 H  -0.7169000       2.274700      2.0000001E-03
 H    1.676300       2.827900      1.4000000E-03
 H    3.374100       1.034600      6.9999998E-04
 H    3.869000      -1.358200     -1.7000000E-03
 H    2.595400      -2.559600     -2.4000001E-03


%chk=000005579-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005579

1 1
N -1.839836 -0.217216 0.000099
N 2.968153 -1.572270 -0.006283
C -0.340917 0.118223 0.000725
C -2.495604 0.383227 -1.252640
C -2.493722 0.371213 1.259493
C -2.120532 -1.718359 -0.006994
C 0.616390 -0.911628 -0.003222
C 0.020094 1.482665 0.005646
C 2.007485 -0.577561 -0.002408
C 1.399191 1.800856 0.006364
C 2.382086 0.800082 0.002440
H -2.006394 -0.043615 -2.140408
H -3.568858 0.136306 -1.245036
H -2.359672 1.472528 -1.249608
H -2.357931 1.460522 1.266436
H -3.566940 0.124116 1.251393
H -2.002941 -0.063895 2.142376
H -1.691294 -2.177830 0.894776
H -3.211753 -1.860815 -0.008040
H -1.690598 -2.169354 -0.912709
H 0.339530 -1.968584 -0.007005
H -0.715042 2.292169 0.008777
H 1.701845 2.852403 0.010073
H 3.442403 1.074047 0.003079
H 3.958007 -1.337785 -0.005706
H 2.721449 -2.558747 -0.009716


