%chk=000131796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131796

0 1
 O    4.086600      -1.534200     -0.3738000    
 N  -0.5260000      0.8245000     -7.5199999E-02
 N   -1.623600      -1.234800      3.6899999E-02
 N    2.558500     -0.1426000      0.4893000    
 N   -1.610900       2.833400     -0.1386000    
 N   3.9600000E-02  -2.719500      6.3900001E-02
 N    2.843400      -2.147400     -0.5750000    
 C    4.931500      0.6275000      0.6644000    
 C    5.880100       1.126300     -0.3882000    
 C    4.844100       2.048500      0.1844000    
 C    3.828700     -0.3596000      0.2586000    
 C  -0.4452000     -0.5175000     -1.9300001E-02
 C   0.5884000       1.726600     -0.1386000    
 C   -1.701300       1.529800     -7.9700001E-02
 C   0.5602000      -1.451100     -1.1000000E-03
 C   -2.973300      0.7786000     -1.9700000E-02
 C   -2.905900     -0.6304000      3.8899999E-02
 C  -0.1352000       3.086300     -0.1824000    
 C    1.993100      -1.266100     -3.9799999E-02
 C   -1.268000      -2.559000      8.5600004E-02
 C   -4.205800       1.428400     -2.0400001E-02
 C   -4.076000      -1.385800      9.6600004E-02
 C   -5.373800      0.6672000      3.7500001E-02
 C   -5.309200     -0.7290000      9.5500000E-02
 H    5.337200      0.4666000       1.656900    
 H    5.748400      0.7970000      -1.411800    
 H    6.912100       1.287500     -0.1010000    
 H    5.179900       2.828800      0.8565000    
 H    4.019500       2.336900     -0.4565000    
 H    1.206300       1.585700      -1.031000    
 H    1.194700       1.703100      0.7706000    
 H   0.1512000       3.712700      0.6693000    
 H   0.1104000       3.627500      -1.102400    
 H   -1.985400      -3.366500      0.1355000    
 H   -4.278000       2.510700     -6.4999998E-02
 H   -4.065300      -2.469800      0.1426000    
 H   -6.341200       1.161900      3.7500001E-02
 H   -6.227700      -1.308000      0.1402000    


%chk=000131796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131796

0 1
O 4.233136 -1.779730 -0.204058
N -0.514595 0.857989 -0.348311
N -1.616009 -1.211980 0.118335
N 2.764184 -0.099783 0.215534
N -1.676223 2.834276 -0.698579
N 0.061867 -2.729660 0.250916
N 2.878081 -2.372019 -0.326706
C 5.246023 0.400385 0.300747
C 5.189378 1.899106 -0.084734
C 5.229737 1.506152 1.385657
C 4.050995 -0.429045 0.114328
C -0.410630 -0.493815 -0.085068
C 0.567818 1.791994 -0.768012
C -1.757627 1.554678 -0.400683
C 0.627072 -1.450529 0.013801
C -2.985190 0.793896 -0.134443
C -2.901354 -0.605676 0.120352
C -0.217231 3.146793 -0.868426
C 2.071126 -1.305785 -0.051111
C -1.255827 -2.561450 0.313246
C -4.250935 1.428385 -0.140612
C -4.077036 -1.354072 0.366579
C -5.420136 0.685082 0.103291
C -5.327901 -0.707031 0.356602
H 6.185587 -0.131395 0.133852
H 4.240537 2.259556 -0.490823
H 6.085144 2.324745 -0.544489
H 6.154704 1.657762 1.948024
H 4.308083 1.600338 1.965531
H 0.981236 1.462773 -1.740227
H 1.386532 1.784795 -0.034337
H 0.087442 3.855574 -0.075882
H -0.060572 3.646012 -1.840263
H -1.979673 -3.348058 0.500376
H -4.281581 2.503580 -0.341699
H -4.022441 -2.427989 0.566295
H -6.396905 1.178593 0.097912
H -6.234715 -1.290244 0.548283


