%chk=000015223.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015223

0 1
 O   -2.714300     -0.8335000     -2.8700000E-02
 O   -3.589300      0.7416000       1.411100    
 N    2.859400     -3.5999999E-03  0.1580000    
 C    1.466500     -0.1973000     -0.2445000    
 C   0.9630000      -1.552100      0.2672000    
 C   0.5915000      0.9508000      0.2742000    
 C  -0.5069000      -1.766000     -8.5299999E-02
 C  -0.8777000      0.7310000     -7.7000000E-02
 C   -1.381200     -0.6220000      0.4233000    
 C    3.708000      -1.066100     -0.3995000    
 C    3.333200       1.325500     -0.2533000    
 C    5.160400     -0.9062000      5.2200001E-02
 C    4.773400       1.563700      0.2033000    
 C    5.705200      0.4712000     -0.3088000    
 C   -3.634300      9.9699996E-02  0.3697000    
 C   -4.733400      0.2135000     -0.6720000    
 C   -5.840900     -0.7870000     -0.3629000    
 C   -5.282400       1.636800     -0.7268000    
 H    1.396500     -0.2001000      -1.342500    
 H    1.089900      -1.623400       1.355200    
 H    1.495100      -2.395300     -0.1821000    
 H   0.8543000       1.911100     -0.1804000    
 H   0.6945000       1.054800       1.362000    
 H  -0.6208000      -1.863200      -1.173100    
 H  -0.8605000      -2.715500      0.3347000    
 H   -1.462000       1.557400      0.3418000    
 H   -1.014400      0.7950000      -1.164900    
 H   -1.372900     -0.6422000       1.521300    
 H    3.660300      -1.076600      -1.496300    
 H    3.418500      -2.057500     -4.3099999E-02
 H    2.768000       2.130300      0.2242000    
 H    3.260200       1.455600      -1.340900    
 H    5.781100      -1.680900     -0.4123000    
 H    5.226800      -1.051400       1.138100    
 H    4.812900       1.591600       1.299900    
 H    5.119600       2.540300     -0.1538000    
 H    6.707400      0.6023000      0.1136000    
 H    5.800800      0.5529000      -1.398500    
 H   -4.299000     -1.1300000E-02  -1.654200    
 H   -6.632600     -0.7403000      -1.117600    
 H   -6.289900     -0.5929000      0.6176000    
 H   -5.448200      -1.809600     -0.3465000    
 H   -6.028200       1.736100      -1.522300    
 H   -4.478500       2.354800     -0.9228000    
 H   -5.755200       1.921300      0.2198000    


%chk=000015223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015223

0 1
O -2.750015 -0.501606 -0.471902
O -3.625061 0.753896 1.292596
N 3.001178 -0.022126 0.037909
C 1.575530 -0.085111 -0.426821
C 0.920381 -1.406243 0.067732
C 0.719194 1.111010 0.062891
C -0.549577 -1.545287 -0.394247
C -0.756205 0.982152 -0.389912
C -1.364863 -0.343787 0.092457
C 3.867089 -0.950637 -0.741878
C 3.609167 1.335890 0.059825
C 5.278826 -1.064821 -0.133339
C 5.017255 1.303239 0.692959
C 5.948675 0.324243 -0.053882
C -3.793330 0.109073 0.229738
C -5.133885 -0.109196 -0.467049
C -6.133733 -0.763454 0.519443
C -5.668149 1.255317 -0.979056
H 1.536978 -0.076384 -1.551073
H 0.979717 -1.414241 1.174130
H 1.489531 -2.284196 -0.286484
H 1.113694 2.065424 -0.329267
H 0.772780 1.162965 1.169526
H -0.602175 -1.591024 -1.499937
H -0.988171 -2.483035 -0.006296
H -1.345367 1.830615 0.001966
H -0.812877 1.013966 -1.496461
H -1.452396 -0.336369 1.196415
H 3.955731 -0.603061 -1.807154
H 3.397721 -1.948760 -0.766117
H 2.972303 2.009404 0.655669
H 3.683668 1.767942 -0.975042
H 5.886485 -1.759874 -0.744869
H 5.194804 -1.495865 0.882975
H 4.918956 0.984507 1.748985
H 5.439698 2.326997 0.689488
H 6.931390 0.258899 0.450486
H 6.135332 0.701980 -1.080802
H -4.961609 -0.781028 -1.326345
H -7.118010 -0.887582 0.033078
H -6.259788 -0.126778 1.412794
H -5.785223 -1.758128 0.851115
H -6.640974 1.113047 -1.483131
H -4.971261 1.719326 -1.700214
H -5.809513 1.952002 -0.133800


