%chk=000056260.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056260

0 1
 O   -2.770100      -2.156000     -0.9113000    
 O   -5.528300       1.427600     -4.3200001E-02
 O   0.6649000     -0.6822000       1.775000    
 N  -0.5335000     -0.7702000     -0.2122000    
 N   -4.109400     -0.3340000     -0.4862000    
 C   -1.791800     -0.3205000      0.3213000    
 C   -1.927000       1.190000      0.2151000    
 C   -3.279400       1.614300      0.7579000    
 C   -2.900100      -1.026800     -0.4388000    
 C   -4.408300      0.9225000      3.1599998E-02
 C   0.6066000     -0.9157000      0.5705000    
 C    1.786700      -1.408200     -0.2449000    
 C    2.957000     -0.4607000     -0.2333000    
 C    3.045800      0.5271000      -1.204000    
 C    3.929800     -0.5883000      0.7484000    
 C    4.129700       1.405100      -1.193300    
 C    5.013600      0.2897000      0.7591000    
 C    5.113500       1.286400     -0.2118000    
 H   -1.865000     -0.6312000       1.370900    
 H   -1.829800       1.508000     -0.8316000    
 H   -1.127700       1.688800      0.7757000    
 H   -3.400400       2.696300      0.6377000    
 H   -3.364600       1.377300       1.824300    
 H  -0.4819000     -0.9607000      -1.208900    
 H   -4.870600     -0.8070000     -0.9657000    
 H    1.498100      -1.617300      -1.282300    
 H    2.084900      -2.379900      0.1698000    
 H    2.283500      0.6289000      -1.971200    
 H    3.860600      -1.359800       1.510100    
 H    4.207200       2.181500      -1.948700    
 H    5.779500      0.1977000       1.523700    
 H    5.957200       1.970200     -0.2031000    


%chk=000056260-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000056260

0 1
O -2.517605 -1.128266 -2.076893
O -5.352738 1.691879 0.268575
O 0.455261 -1.082215 1.804411
N -0.448227 -0.911423 -0.324635
N -3.918396 0.233210 -0.817602
C -1.747565 -0.454306 0.165182
C -1.733895 0.962018 0.794976
C -3.149108 1.305158 1.303706
C -2.736865 -0.499290 -1.005058
C -4.234478 1.120514 0.249595
C 0.577764 -1.221774 0.546039
C 1.880210 -1.704576 -0.108992
C 2.893076 -0.567482 -0.252298
C 3.343108 -0.155080 -1.531171
C 3.393590 0.094520 0.899165
C 4.279620 0.896843 -1.661276
C 4.327136 1.146019 0.769807
C 4.774813 1.550682 -0.510351
H -2.102911 -1.158529 0.950376
H -1.393400 1.699563 0.044712
H -1.013896 0.964396 1.628695
H -3.218003 2.345248 1.663372
H -3.410869 0.659714 2.167028
H -0.391725 -1.140134 -1.322374
H -4.624508 0.158098 -1.561143
H 1.679151 -2.159800 -1.095785
H 2.285460 -2.492165 0.551224
H 2.966964 -0.661769 -2.428961
H 3.037547 -0.212883 1.889208
H 4.621888 1.201852 -2.656688
H 4.707353 1.648377 1.666557
H 5.501948 2.364504 -0.608799


