%chk=000025814.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025814

0 1
 N    3.840200     -0.1118000     -4.9999999E-03
 C   0.2233000     -0.7797000     -6.1600000E-02
 C  -0.8987000      -1.793900     -0.1406000    
 C  -0.2994000      0.5293000      3.8899999E-02
 C   -2.123200     -0.9055000     -7.3200002E-02
 C   -1.744500      0.4517000      3.1599998E-02
 C    1.586900      -1.014500     -7.8199998E-02
 C    2.441500      8.6000003E-02  8.1000002E-03
 C   0.5486000       1.620700      0.1243000    
 C   -3.453800      -1.284600     -0.1029000    
 C   -2.705200       1.446400      0.1081000    
 C    1.927700       1.390400      0.1086000    
 C   -4.422000     -0.2818000     -2.5900001E-02
 C   -4.051500       1.070000      7.8500003E-02
 C    4.717700      0.9025000     -0.5514000    
 C    4.412500      -1.325200      0.5408000    
 H  -0.8664000      -2.474700      0.7150000    
 H  -0.8649000      -2.335900      -1.090100    
 H    1.952600      -2.031700     -0.1675000    
 H   0.1665000       2.632900      0.2051000    
 H   -3.741200      -2.327000     -0.1834000    
 H   -2.434800       2.493800      0.1892000    
 H    2.584300       2.252900      0.1897000    
 H   -5.475500     -0.5477000     -4.6799999E-02
 H   -4.823800       1.832600      0.1371000    
 H    5.697100      0.4814000     -0.8052000    
 H    4.883600       1.705200      0.1748000    
 H    4.311800       1.331100      -1.474800    
 H    3.927100      -1.610600       1.481000    
 H    5.477400      -1.194400      0.7637000    
 H    4.325500      -2.151000     -0.1730000    


%chk=000025814-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025814

0 1
N 3.897877 -0.106330 -0.007999
C 0.222248 -0.785494 0.033924
C -0.915504 -1.802819 0.084068
C -0.314631 0.535987 -0.027069
C -2.163334 -0.924009 0.045602
C -1.784468 0.454198 -0.019222
C 1.603566 -1.016636 0.040979
C 2.510384 0.094649 -0.014449
C 0.569092 1.635808 -0.082688
C -3.518252 -1.293657 0.064896
C -2.774426 1.462588 -0.063401
C 1.960606 1.419426 -0.076881
C -4.511137 -0.280075 0.019875
C -4.138176 1.085489 -0.043355
C 4.807831 1.041740 -0.084430
C 4.442684 -1.465909 0.068199
H -0.875998 -2.421698 1.002296
H -0.879812 -2.504939 -0.772335
H 1.983226 -2.041664 0.086742
H 0.186311 2.662032 -0.130696
H -3.812146 -2.349087 0.114085
H -2.496061 2.521669 -0.112714
H 2.627089 2.285061 -0.120071
H -5.572208 -0.553899 0.034274
H -4.915969 1.857252 -0.077182
H 5.849806 0.684448 -0.079938
H 4.681024 1.729859 0.776944
H 4.654172 1.629158 -1.013127
H 4.115977 -1.989962 0.990097
H 5.543250 -1.420499 0.078668
H 4.136378 -2.085786 -0.800191


