%chk=000023897.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023897

0 1
 O   -5.721800      4.9400002E-02 -0.6180000    
 O   0.7435000      -2.057200      0.2191000    
 N   -3.055200     -0.1413000      0.3586000    
 N    3.096900       1.847200     -1.7000000E-03
 C  -0.6434000     -7.8900002E-02 -6.6399999E-02
 C  -0.5766000       1.348000      0.5269000    
 C   -1.797200     -0.8572000      0.5603000    
 C   0.5864000       2.169700     -5.3800002E-02
 C    1.891800     -2.2800000E-02  8.7099999E-02
 C    1.822900       1.351800      8.2000000E-03
 C   0.6889000     -0.8352000      0.1150000    
 C    3.262400     -0.3720000      0.1372000    
 C   -3.339300      2.0900000E-02  -1.073900    
 C   -4.166300     -0.8434000       1.015900    
 C    3.984400      0.8026000      7.8699999E-02
 C   -4.661700      0.7598000      -1.258800    
 C   -5.469600     -8.5199997E-02  0.7812000    
 C    3.828000      -1.733700      0.2312000    
 C    5.440500       1.044200      9.2799999E-02
 C    4.085500      -2.366600      -1.139900    
 H  -0.7464000     -1.5699999E-02  -1.156400    
 H  -0.4503000       1.279900       1.616500    
 H   -1.501900       1.906300      0.3477000    
 H   -1.605600     -0.9798000       1.634600    
 H   -1.849400      -1.868100      0.1343000    
 H   0.7014000       3.101300      0.5108000    
 H   0.3734000       2.431500      -1.096700    
 H   -2.589000      0.6261000      -1.588600    
 H   -3.394100     -0.9579000      -1.567700    
 H   -4.261000      -1.862400      0.6182000    
 H   -3.986300     -0.9149000       2.094700    
 H    3.345100       2.825900     -5.4299999E-02
 H   -4.613800       1.781700     -0.8628000    
 H   -4.905100      0.8287000      -2.323900    
 H   -6.306800     -0.6387000       1.218500    
 H   -5.449400      0.9078000       1.246700    
 H    4.775500      -1.705800      0.7840000    
 H    3.170500      -2.388200      0.8136000    
 H    5.682600       2.093100     -0.1077000    
 H    5.860900      0.7827000       1.069200    
 H    5.940000      0.4369000     -0.6687000    
 H    3.156400      -2.454900      -1.712900    
 H    4.509800      -3.368300      -1.019500    
 H    4.788100      -1.765800      -1.726900    


%chk=000023897-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023897

0 1
O -5.897477 -0.033735 -0.565966
O 0.748610 -2.043209 -0.001602
N -3.087401 -0.176357 0.188509
N 3.203715 1.911165 0.205661
C -0.583357 0.031969 -0.062700
C -0.511567 1.399226 0.665361
C -1.770852 -0.822473 0.437283
C 0.650957 2.279791 0.142224
C 1.962483 0.039762 0.103178
C 1.902651 1.450511 0.146825
C 0.746810 -0.768613 0.028276
C 3.366497 -0.356177 0.144721
C -3.512814 -0.257685 -1.233432
C -4.155311 -0.731171 1.061622
C 4.115315 0.824736 0.206773
C -4.834629 0.502092 -1.432277
C -5.467518 0.037613 0.841206
C 3.904764 -1.767379 0.098439
C 5.597246 1.065077 0.265336
C 3.855871 -2.389975 -1.322467
H -0.722562 0.236139 -1.149333
H -0.369084 1.219015 1.749782
H -1.482198 1.912028 0.541823
H -1.664859 -0.959337 1.531264
H -1.703633 -1.836650 -0.018472
H 0.760214 3.187558 0.767916
H 0.415577 2.628173 -0.886419
H -2.737643 0.194658 -1.880060
H -3.645659 -1.321589 -1.555767
H -4.331145 -1.817690 0.857870
H -3.842809 -0.629143 2.118347
H 3.477083 2.891855 0.263178
H -4.678766 1.580269 -1.208816
H -5.209506 0.386407 -2.462863
H -6.292857 -0.404366 1.423815
H -5.327876 1.100792 1.135290
H 4.947538 -1.783791 0.471444
H 3.304569 -2.405446 0.772181
H 5.969849 1.607490 -0.625989
H 5.893194 1.648471 1.159463
H 6.132696 0.102759 0.309049
H 2.810155 -2.457317 -1.668043
H 4.278379 -3.411915 -1.314301
H 4.430052 -1.782038 -2.045928


