%chk=000035435.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035435

0 1
 O    4.010000      0.6413000      -2.115600    
 O    3.958700      -2.098000       1.089100    
 O    1.310200       1.476500       1.321500    
 N    2.209000     -0.1688000     -4.8700001E-02
 C    3.619700      0.1264000      0.2097000    
 C    4.103700       1.169000     -0.7982000    
 C    4.438500      -1.165700      0.1269000    
 C    1.188000      0.5411000      0.5374000    
 C  -0.1426000      3.1099999E-02  9.9299997E-02
 C   -2.628300      0.1939000      0.1849000    
 C   -1.263700      0.6078000      0.5565000    
 C   -2.834700      -1.073300     -0.3358000    
 C   -3.678300       1.080000      0.3634000    
 C   -4.126300      -1.465100     -0.6877000    
 C   -4.970000      0.6881000      1.1400000E-02
 C   -5.193900     -0.5844000     -0.5141000    
 H    3.693200      0.5374000       1.223700    
 H    5.149200       1.433100     -0.6115000    
 H    3.506100       2.085400     -0.7508000    
 H    4.356500      -1.633700     -0.8599000    
 H    5.494500     -0.9657000      0.3358000    
 H    1.999700     -0.9025000     -0.7198000    
 H  -0.1502000     -0.7907000     -0.6075000    
 H   -1.205300       1.448800       1.243800    
 H    3.075900      0.4241000      -2.276400    
 H    4.506800      -2.897200       1.009400    
 H   -2.039000      -1.799600     -0.4673000    
 H   -3.519800       2.075200      0.7702000    
 H   -4.302300      -2.457700      -1.092100    
 H   -5.801500       1.373700      0.1464000    
 H   -6.199800     -0.8900000     -0.7870000    


%chk=000035435-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035435

0 1
O 4.162412 0.919805 -1.980527
O 3.864543 -2.306691 0.689609
O 1.356962 1.776616 0.522186
N 2.294827 -0.293151 -0.020449
C 3.677647 0.091290 0.328602
C 4.191771 1.259934 -0.552239
C 4.581399 -1.139384 0.134603
C 1.209372 0.554028 0.187814
C -0.121556 -0.083276 -0.029209
C -2.656440 0.175834 -0.000501
C -1.268594 0.635407 0.156104
C -3.004009 -1.149802 -0.394674
C -3.710391 1.099903 0.254618
C -4.353067 -1.531441 -0.526807
C -5.062100 0.718530 0.122807
C -5.389624 -0.600005 -0.268732
H 3.710051 0.425733 1.386632
H 5.253432 1.458768 -0.324633
H 3.591330 2.161471 -0.337839
H 4.778755 -1.279237 -0.947349
H 5.538261 -0.971605 0.667177
H 2.139236 -1.307342 -0.047628
H -0.140222 -1.138366 -0.333173
H -1.126369 1.683361 0.460719
H 3.214547 0.775407 -2.232406
H 4.404285 -3.124590 0.560424
H -2.216444 -1.883994 -0.598339
H -3.458293 2.123338 0.558324
H -4.602768 -2.554326 -0.830422
H -5.856879 1.445136 0.324147
H -6.438075 -0.900852 -0.371841


