%chk=000028290.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028290

0 1
 O    3.059200      -1.933400      0.3028000    
 O    4.150300      0.1091000     -0.3621000    
 N   -2.043500       1.403500      0.4123000    
 C   -2.641700      -1.821000     -0.1800000    
 C   -2.045600     -0.9280000      0.9542000    
 C   -1.284800      0.2914000      0.5392000    
 C   -3.693200     -0.9926000     -0.9467000    
 C   -1.556400      -2.261600      -1.177200    
 C   -3.336800      -3.067900      0.3932000    
 C   9.0899996E-02  0.2432000      0.3113000    
 C   0.7308000       1.450000     -8.0799997E-02
 C   0.8348000     -0.9412000      0.4579000    
 C  -4.0800001E-02   2.608700     -0.2167000    
 C    2.191000     -0.8893000      0.2102000    
 C   -1.401700       2.531100      3.7999999E-02
 C    2.115700       1.457400     -0.3230000    
 C    2.813100      0.2758000     -0.1689000    
 C   -2.240200       3.758200     -0.1019000    
 C    4.299000      -1.293500     -6.1799999E-02
 H   -2.881700     -0.5911000       1.586400    
 H   -1.455900      -1.543600       1.643900    
 H   -3.243200     -0.1491000      -1.480700    
 H   -4.203600      -1.607600      -1.697400    
 H   -4.460200     -0.5981000     -0.2707000    
 H   -1.059000      -1.418100      -1.664300    
 H  -0.8100000      -2.905600     -0.7041000    
 H   -2.004600      -2.856500      -1.983300    
 H   -3.776600      -3.682600     -0.4000000    
 H   -2.625000      -3.692200      0.9446000    
 H   -4.139300      -2.787800       1.084600    
 H   0.4138000      -1.882800      0.7851000    
 H   0.4124000       3.550200     -0.5147000    
 H    2.631800       2.364400     -0.6237000    
 H   -3.289700       3.545800      0.1276000    
 H   -1.894800       4.535800      0.5868000    
 H   -2.189600       4.139000      -1.126900    
 H    4.709300      -1.799600     -0.9432000    
 H    5.007100      -1.401700      0.7677000    


%chk=000028290-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028290

0 1
O 3.297055 -1.895698 0.357361
O 4.334660 0.167829 -0.294363
N -2.007443 1.356777 0.378563
C -2.763283 -1.820866 -0.225601
C -2.059013 -1.009733 0.928445
C -1.271461 0.223159 0.513997
C -3.824627 -0.945468 -0.940444
C -1.734957 -2.335794 -1.265696
C -3.469647 -3.034840 0.437245
C 0.159936 0.207070 0.301695
C 0.798822 1.457087 -0.085826
C 0.965323 -0.979361 0.472044
C -0.019720 2.616591 -0.233227
C 2.322821 -0.873137 0.249591
C -1.399106 2.540381 0.003406
C 2.222476 1.517331 -0.309608
C 2.943755 0.353850 -0.137320
C -2.305186 3.749143 -0.126413
C 4.594120 -1.265727 0.005288
H -2.854278 -0.662883 1.613801
H -1.419810 -1.710118 1.498433
H -3.366013 -0.066413 -1.424272
H -4.347891 -1.539473 -1.714407
H -4.576857 -0.568267 -0.223710
H -1.196284 -1.501400 -1.749848
H -0.984636 -3.003544 -0.800753
H -2.250185 -2.912365 -2.057065
H -3.998511 -3.640896 -0.322012
H -2.742141 -3.692615 0.950569
H -4.215095 -2.701903 1.184206
H 0.520414 -1.931131 0.764370
H 0.436006 3.569600 -0.524286
H 2.702039 2.455414 -0.601186
H -3.340912 3.455336 0.104015
H -2.004911 4.556046 0.568078
H -2.276096 4.169051 -1.149354
H 4.997570 -1.752113 -0.899192
H 5.274366 -1.332219 0.871179


