%chk=000021401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021401

0 1
 O    2.335800      0.4906000      0.4498000    
 O   -2.579400      0.2122000     -0.9420000    
 O    1.073500      0.8859000      -1.427800    
 N   0.2173000       1.186200      0.7074000    
 C    3.164100     -0.4647000     -0.2226000    
 C   -1.111800       1.617600      0.3404000    
 C    4.399400     -0.7384000      0.6217000    
 C    2.361200      -1.731000     -0.4793000    
 C   -2.021500      0.4296000      0.2635000    
 C    1.195300      0.8575000     -0.2076000    
 C   -2.401900     -0.4882000       1.186000    
 C   -3.278500      -1.362900      0.5008000    
 C   -3.353500     -0.8944000     -0.7901000    
 H    3.495200     -3.4800000E-02  -1.176100    
 H   -1.073300       2.147700     -0.6170000    
 H   -1.463100       2.311000       1.110900    
 H    5.070000      -1.449700      0.1303000    
 H    4.948800      0.1912000      0.8054000    
 H    4.120800      -1.137700       1.603100    
 H    2.998900      -2.520000     -0.8915000    
 H    1.543700      -1.572000      -1.188600    
 H    1.908900      -2.101300      0.4477000    
 H   0.4420000       1.108100       1.694800    
 H   -2.099700     -0.5389000       2.222000    
 H   -3.791400      -2.226900      0.8981000    
 H   -3.884600      -1.218100      -1.673400    


%chk=000021401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021401

0 1
O 2.235527 -0.285650 0.538473
O -2.464060 -0.725220 -0.453365
O 1.385571 1.025397 -1.238202
N 0.119072 0.524379 0.676737
C 3.523948 -0.470606 -0.215017
C -1.093358 1.234815 0.241766
C 4.581426 -0.737771 0.858814
C 3.357021 -1.614202 -1.225996
C -2.341992 0.416195 0.372385
C 1.247612 0.472751 -0.113982
C -3.486041 0.541942 1.146416
C -4.366474 -0.557086 0.801604
C -3.713825 -1.301582 -0.164955
H 3.724014 0.476787 -0.749824
H -0.913805 1.531149 -0.808136
H -1.236574 2.163370 0.828229
H 5.572818 -0.863807 0.387166
H 4.636620 0.102113 1.572279
H 4.343396 -1.658639 1.420247
H 4.305314 -1.779400 -1.770158
H 2.575013 -1.367124 -1.963298
H 3.083368 -2.551501 -0.709400
H 0.127563 0.019972 1.563775
H -3.679349 1.326655 1.875782
H -5.350377 -0.763095 1.217996
H -3.956229 -2.201243 -0.723439


