%chk=000017398.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017398

0 1
 N    3.243700       1.588500     -6.3500002E-02
 N   6.4700000E-02  -2.742200       2.295900    
 C   0.7840000      -1.416600      9.7099997E-02
 C    1.821300     -0.3151000      0.5475000    
 C  -0.4304000     -0.8305000     -0.5546000    
 C    2.300700      0.6026000     -0.5846000    
 C    1.589400      -2.445200     -0.7647000    
 C   -1.260200      8.9199997E-02  0.1072000    
 C  -0.7142000      -1.234600      -1.859400    
 C   -2.394100      0.6062000     -0.5639000    
 C   0.3925000      -2.169100       1.341100    
 C  -0.9896000      0.5070000       1.420300    
 C   -1.829300     -0.7265000      -2.519300    
 C   -2.664700      0.1879000      -1.877000    
 C    3.675900       2.496700      -1.126200    
 C    4.399200      0.9246000      0.5403000    
 C   -3.223900       1.526000      9.8099999E-02
 C   -1.825000       1.421200       2.062700    
 C   -2.939900       1.929800       1.403000    
 H    2.675400     -0.8727000      0.9565000    
 H    1.507500      0.3096000       1.383100    
 H    2.759100      1.9800000E-02  -1.391500    
 H    1.439600       1.130300      -1.009900    
 H    2.460300      -2.826300     -0.2154000    
 H    1.963700      -2.015400      -1.699400    
 H   0.9800000      -3.323900      -1.013100    
 H  -0.1105000      -1.940400      -2.417300    
 H  -0.2158000      0.1135000       2.059100    
 H   -2.050900      -1.041100      -3.535200    
 H   -3.530600      0.5721000      -2.412100    
 H    2.815500       3.015900      -1.563200    
 H    4.206600       1.971900      -1.928900    
 H    4.336800       3.273200     -0.7251000    
 H    4.153800      0.4725000       1.506200    
 H    5.182700       1.657800      0.7693000    
 H    4.840600      0.1664000     -0.1168000    
 H   -4.101300       1.935500     -0.3980000    
 H   -1.618000       1.721400       3.086100    
 H   -3.592500       2.637800       1.905600    


%chk=000017398-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017398

0 1
N 3.274597 1.519548 -0.194749
N 0.113813 -2.823509 2.419993
C 0.821914 -1.512300 0.189781
C 1.907913 -0.431303 0.581377
C -0.402707 -0.850896 -0.508267
C 2.471194 0.350259 -0.625668
C 1.499841 -2.625110 -0.674026
C -1.277969 0.076763 0.190047
C -0.641791 -1.109219 -1.864856
C -2.346159 0.726238 -0.553947
C 0.398535 -2.211006 1.435418
C -1.164784 0.393403 1.588492
C -1.699038 -0.475936 -2.586457
C -2.532806 0.434265 -1.944218
C 3.499477 2.468068 -1.305354
C 4.540408 1.145904 0.469715
C -3.216717 1.654778 0.107739
C -2.031344 1.296901 2.207055
C -3.065181 1.943579 1.463289
H 2.717254 -0.957790 1.121152
H 1.474873 0.309964 1.273708
H 3.069541 -0.329296 -1.287724
H 1.625517 0.730525 -1.227758
H 2.335593 -3.066939 -0.105083
H 1.910413 -2.209211 -1.608428
H 0.788365 -3.430562 -0.922634
H -0.008101 -1.814441 -2.407747
H -0.408776 -0.098274 2.204184
H -1.842077 -0.712523 -3.646178
H -3.343987 0.933489 -2.487192
H 2.528165 2.792570 -1.718730
H 4.108365 2.040004 -2.142920
H 4.025551 3.362653 -0.926874
H 4.340399 0.555296 1.379666
H 5.076310 2.061112 0.777725
H 5.223323 0.549657 -0.189827
H -4.012079 2.131948 -0.477352
H -1.920080 1.506354 3.276363
H -3.735668 2.652839 1.960286


