%chk=000028714.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028714

0 1
 O  -0.1929000      -2.611400       1.412100    
 N   0.2991000      -2.656700     -0.8843000    
 C   4.2500000E-02 -0.7058000     -0.2715000    
 C    1.176100      0.1601000      0.2750000    
 C    2.523200     -0.5627000      0.1408000    
 C    1.211800       1.518900     -0.4374000    
 C   0.3819000      -1.393900      -1.599600    
 C   7.1000000E-03  -2.114900      0.3272000    
 C    3.679800      0.3049000      0.6320000    
 C    2.370700       2.383100      5.4600000E-02
 C    3.706900       1.657900     -7.2099999E-02
 C   -1.291200      6.3999998E-03 -9.4599999E-02
 C   -1.824000      0.2419000       1.189000    
 C   -2.030900      0.4504000      -1.209200    
 C   -3.046200      0.8942000       1.351200    
 C   -3.253100       1.102900      -1.046800    
 C   -3.760700       1.324700      0.2334000    
 H    1.016700      0.3457000       1.347000    
 H    2.771200     -0.8271000     -0.8888000    
 H    2.526200      -1.494700      0.7176000    
 H   0.2865000       2.081400     -0.2737000    
 H    1.303100       1.375600      -1.521700    
 H  -0.3776000      -1.369600      -2.387900    
 H    1.336100      -1.231200      -2.098700    
 H    4.629900     -0.2158000      0.4665000    
 H    3.585900      0.4586000       1.714200    
 H    2.201900       2.657400       1.103200    
 H    2.403200       3.316800     -0.5183000    
 H    4.504800       2.278200      0.3513000    
 H    3.943700       1.512400      -1.133200    
 H   0.4227000      -3.622500      -1.154900    
 H   -1.284800     -8.2999997E-02   2.075600    
 H   -1.657600      0.3205000      -2.220200    
 H   -3.441200       1.067700       2.347900    
 H   -3.806900       1.444000      -1.916600    
 H   -4.711500       1.834100      0.3598000    


%chk=000028714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028714

0 1
O -0.012556 -2.635460 1.495638
N 0.278044 -2.725726 -0.906945
C 0.012236 -0.703744 -0.288891
C 1.194791 0.209829 0.187294
C 2.555722 -0.530903 0.272967
C 1.331314 1.489711 -0.681803
C 0.231962 -1.447491 -1.671096
C 0.073330 -2.153291 0.345875
C 3.672091 0.401725 0.801790
C 2.450977 2.419617 -0.155932
C 3.804984 1.679175 -0.059681
C -1.338321 -0.021532 -0.095778
C -1.933905 -0.014593 1.194273
C -2.001048 0.650398 -1.154292
C -3.161855 0.646128 1.415234
C -3.230237 1.312961 -0.933221
C -3.815197 1.314543 0.353178
H 0.929037 0.529004 1.218589
H 2.845851 -0.901870 -0.732331
H 2.466160 -1.414456 0.932435
H 0.370280 2.035607 -0.708262
H 1.566791 1.197052 -1.727946
H -0.617692 -1.387462 -2.371239
H 1.174518 -1.204574 -2.190641
H 4.634737 -0.144575 0.831197
H 3.437610 0.690764 1.847195
H 2.168954 2.793402 0.850033
H 2.541728 3.306828 -0.812289
H 4.579635 2.348203 0.362596
H 4.142737 1.399567 -1.079552
H 0.404307 -3.695706 -1.202941
H -1.440134 -0.549159 2.013848
H -1.556616 0.664994 -2.156768
H -3.611835 0.634918 2.414386
H -3.727638 1.827636 -1.763302
H -4.768366 1.826981 0.525280


