%chk=000020587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020587

0 1
 O   -1.938900      -3.076800     -0.5552000    
 O   -3.631300       2.114500     -0.2411000    
 N  -0.6057000      0.1707000      0.5688000    
 C   0.7082000      6.2300000E-02 -6.2199999E-02
 C    1.346300       1.451000     -0.1786000    
 C    1.597600     -0.8884000      0.7466000    
 C    2.754900       1.369000     -0.7644000    
 C    3.005600     -0.9679000      0.1591000    
 C    3.640500      0.4140000      3.0800000E-02
 C   -1.227300      -1.148000      0.6868000    
 C   -1.466600       1.074700     -0.1938000    
 C   -1.366400      -1.781800     -0.6869000    
 C   -2.816900       1.206500      0.4900000    
 H   0.6444000     -0.3020000      -1.094300    
 H    1.390700       1.938400      0.8041000    
 H   0.7901000       2.111600     -0.8510000    
 H    1.224300      -1.916700      0.7483000    
 H    1.661200     -0.5585000       1.791800    
 H    3.208400       2.366700     -0.7758000    
 H    2.699600       1.031800      -1.806900    
 H    2.963800      -1.443100     -0.8289000    
 H    3.634700      -1.603600      0.7926000    
 H    4.618700      0.3268000     -0.4552000    
 H    3.816300      0.8282000       1.031300    
 H   -2.194000      -1.125400       1.199500    
 H  -0.6702000      -1.809200       1.359800    
 H   -1.576300      0.8148000      -1.253100    
 H   -1.071300       2.096100     -0.1886000    
 H  -0.4164000      -1.950500      -1.196100    
 H   -2.032200      -1.222300      -1.348500    
 H   -2.715200       1.591100       1.510200    
 H   -3.391900      0.2794000      0.5236000    
 H   -2.022800      -3.447400      -1.450400    
 H   -3.738900       1.756300      -1.138700    


%chk=000020587-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020587

0 1
O -2.166636 -3.285468 -0.140642
O -3.617843 2.392217 -0.150937
N -0.615229 0.118010 0.403866
C 0.770698 0.087266 -0.181173
C 1.419126 1.497338 -0.134262
C 1.673777 -0.925957 0.571052
C 2.879338 1.498309 -0.646470
C 3.133844 -0.917382 0.057022
C 3.757117 0.492484 0.127965
C -1.237422 -1.210850 0.633090
C -1.513583 1.091584 -0.269257
C -1.540224 -2.047077 -0.632236
C -2.912593 1.207440 0.370263
H 0.735684 -0.225790 -1.261506
H 1.384204 1.853524 0.915316
H 0.837453 2.214282 -0.741816
H 1.275810 -1.953106 0.472368
H 1.652386 -0.669729 1.649968
H 3.294741 2.521363 -0.564128
H 2.892440 1.236575 -1.725521
H 3.156410 -1.271782 -0.995025
H 3.732332 -1.638115 0.647276
H 4.786549 0.481469 -0.279761
H 3.830979 0.809151 1.188793
H -2.182506 -1.075698 1.186594
H -0.591785 -1.810627 1.294202
H -1.634893 0.877858 -1.367945
H -1.068049 2.096894 -0.191106
H -0.602333 -2.267933 -1.185341
H -2.229410 -1.498470 -1.310377
H -2.817499 1.388640 1.453116
H -3.527151 0.298323 0.209498
H -2.377558 -3.879991 -0.903548
H -3.755174 2.277545 -1.125738


