%chk=000008692.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008692

0 1
 O   0.9998000      0.2462000     -5.6499999E-02
 O    3.164000      -1.408000      0.6852000    
 O    5.636600     -0.9658000     -0.4891000    
 O   0.1659000       2.322100      0.4864000    
 N   -5.068900      -1.300100     -0.2317000    
 C    3.321000     -0.3726000     -0.2878000    
 C    2.331300      0.7446000      2.2399999E-02
 C    4.759600      0.1228000     -0.2190000    
 C   -1.323200      0.5034000      8.6700000E-02
 C   1.0900000E-02   1.145200      0.1996000    
 C   -2.400700       1.269400     -0.3083000    
 C   -1.443800     -0.8396000      0.3794000    
 C   -3.801900     -0.6903000     -0.1247000    
 C   -3.653800      0.6659000     -0.4151000    
 C   -2.696800      -1.443100      0.2725000    
 H    3.107000     -0.8291000      -1.259900    
 H    2.455100       1.563500     -0.6959000    
 H    2.499200       1.125300       1.037500    
 H    5.009100      0.5099000      0.7745000    
 H    4.945500      0.9060000     -0.9597000    
 H   -2.297200       2.325100     -0.5406000    
 H  -0.6023000      -1.444500      0.7036000    
 H   -4.507200       1.263100     -0.7264000    
 H   -2.800000      -2.500100      0.5046000    
 H    3.341600      -1.026100       1.561800    
 H    5.456600      -1.656000      0.1721000    
 H   -5.176600      -2.283700     -2.2600001E-02
 H   -5.870300     -0.7551000     -0.5210000    


%chk=000008692-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008692

0 1
O 1.109087 0.232705 -0.185336
O 3.255029 -1.022627 1.183136
O 5.774460 -1.058720 0.115498
O 0.232902 2.393555 -0.089591
N -5.127765 -1.305503 -0.004284
C 3.435487 -0.335109 -0.112408
C 2.467597 0.838817 -0.235751
C 4.910171 0.097453 -0.110393
C -1.278574 0.478283 -0.090778
C 0.033685 1.152410 -0.118601
C -2.446952 1.278415 0.048315
C -1.425620 -0.931992 -0.204001
C -3.868088 -0.721499 -0.032870
C -3.720196 0.695785 0.079593
C -2.695510 -1.525754 -0.177297
H 3.260467 -1.054884 -0.939082
H 2.590695 1.381891 -1.191096
H 2.576026 1.552313 0.600634
H 5.063419 0.870404 0.673440
H 5.199550 0.510034 -1.091361
H -2.327166 2.363905 0.130823
H -0.533554 -1.553579 -0.322572
H -4.610543 1.326245 0.189963
H -2.794421 -2.614039 -0.269609
H 2.296692 -1.253286 1.280279
H 5.387305 -1.547149 0.889831
H -5.239300 -2.312475 -0.084024
H -5.964381 -0.737198 0.095540


