%chk=000064679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064679

0 1
 S    7.844200     -0.9176000      2.2000000E-02
 N    9.870900       1.082400     -9.9200003E-02
 C   -1.242600      0.3661000      8.4299996E-02
 C   -2.537800     -0.4493000      6.6299997E-02
 C   1.8400000E-02 -0.4999000      2.4999999E-03
 C   -3.800000      0.4195000      8.7499999E-02
 C    1.314700      0.3129000      4.4399999E-02
 C   -5.128400     -0.3375000     -1.8300001E-02
 C    2.543200     -0.5995000     -8.7000001E-03
 C   -6.392200      0.5244000      7.0000000E-02
 C    3.838600      0.2153000      6.0000003E-04
 C   -7.684600     -0.2795000     -9.2500001E-02
 C    5.103300     -0.6506000      2.1000000E-02
 C   -8.945600      0.5832000      2.6000000E-03
 C    6.389700      0.1713000      1.6000000E-03
 C   -10.23450     -0.2127000     -0.1342000    
 C    9.042500      0.2717000     -5.0000001E-02
 H   -1.246600       1.070200     -0.7569000    
 H   -1.210000      0.9677000       1.001000    
 H   -2.553500      -1.129200      0.9268000    
 H   -2.554100      -1.076400     -0.8335000    
 H  -1.0100000E-02  -1.089400     -0.9223000    
 H   1.3800000E-02  -1.215100      0.8345000    
 H   -3.803700       1.008200       1.013500    
 H   -3.748000       1.141400     -0.7373000    
 H    1.334800       1.010900     -0.8012000    
 H    1.341400      0.9137000      0.9614000    
 H   -5.164100      -1.093300      0.7765000    
 H   -5.139700     -0.8872000     -0.9679000    
 H    2.508200      -1.218700     -0.9131000    
 H    2.531900      -1.280300      0.8509000    
 H   -6.404900       1.042500       1.036600    
 H   -6.350700       1.299700     -0.7047000    
 H    3.846300      0.8740000      0.8781000    
 H    3.861600      0.8652000     -0.8831000    
 H   -7.671900     -0.7930000      -1.061700    
 H   -7.722600      -1.058700      0.6787000    
 H    5.080400      -1.322400     -0.8468000    
 H    5.079900      -1.283400      0.9177000    
 H   -8.955200       1.107600      0.9655000    
 H   -8.919000       1.352500     -0.7783000    
 H    6.424200      0.8328000      0.8743000    
 H    6.419600      0.7944000     -0.8991000    
 H   -10.27710     -0.7225000      -1.101900    
 H   -11.10140      0.4511000     -5.9500001E-02
 H   -10.31290     -0.9668000      0.6552000    


%chk=000064679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064679

0 1
S 7.949665 -0.994387 -0.041266
N 10.162157 0.929880 0.179031
C -1.266012 0.390102 0.008968
C -2.577839 -0.425619 -0.034125
C 0.003149 -0.490345 -0.037284
C -3.847832 0.453614 0.012567
C 1.314980 0.325158 0.012065
C -5.159598 -0.362446 -0.028568
C 2.582039 -0.558103 -0.036479
C -6.429953 0.516469 0.019000
C 3.892655 0.259677 0.026764
C -7.741948 -0.299089 -0.024442
C 5.154291 -0.638273 -0.030493
C -9.012157 0.580618 0.028156
C 6.435863 0.200584 0.052888
C -10.318046 -0.241894 -0.020889
C 9.243036 0.163653 0.090358
H -1.249564 1.102169 -0.842610
H -1.249845 1.008482 0.930904
H -2.594395 -1.137676 0.817516
H -2.594584 -1.044261 -0.955907
H -0.011810 -1.105928 -0.961031
H -0.016260 -1.204712 0.812245
H -3.830969 1.073093 0.933816
H -3.832563 1.164983 -0.839692
H 1.333159 1.040998 -0.836101
H 1.329650 0.938398 0.937284
H -5.174978 -1.074156 0.823414
H -5.177006 -0.981694 -0.949963
H 2.571309 -1.164069 -0.966136
H 2.558609 -1.278932 0.806932
H -6.413466 1.134426 0.941357
H -6.414046 1.229417 -0.832001
H 3.905473 0.858815 0.960348
H 3.914406 0.983447 -0.813590
H -7.761876 -0.914389 -0.948486
H -7.758321 -1.014450 0.824538
H 5.145666 -1.222099 -0.971908
H 5.125266 -1.365302 0.804677
H -8.992704 1.192010 0.953579
H -8.993211 1.297753 -0.817881
H 6.520644 0.742467 1.008150
H 6.534386 0.901643 -0.791019
H -10.377511 -0.835048 -0.953098
H -11.210585 0.409209 0.022836
H -10.372922 -0.948493 0.828873


