%chk=000030374.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030374

0 1
 O   0.6302000     -0.1794000     -0.1058000    
 O  -0.7731000     -0.6963000       1.624300    
 N    5.491400     -0.4918000     -8.7899998E-02
 N   -1.583100      5.4000001E-02 -0.4399000    
 C    3.016000     -0.3020000     -0.1203000    
 C    3.127200       1.156500     -0.5780000    
 C    4.260100     -0.7123000      0.6855000    
 C    4.446800       1.388600      -1.306200    
 C    5.635200      0.9204000     -0.4664000    
 C    1.744800     -0.5145000      0.6994000    
 C    6.659500     -0.9393000      0.6707000    
 C  -0.6125000     -0.3110000      0.4727000    
 C   -2.985200      6.8000004E-02 -0.2606000    
 C   -3.724200      -1.066500     -0.5652000    
 C   -3.601600       1.216300      0.2164000    
 C   -5.107800      -1.052400     -0.3894000    
 C   -4.985300       1.230200      0.3924000    
 C   -3.077800      -2.311600      -1.080700    
 C   -2.822100       2.447100      0.5498000    
 C   -5.738400      9.5799997E-02  8.9400001E-02
 H    2.952200     -0.9288000      -1.021300    
 H    3.069000       1.828100      0.2880000    
 H    2.298500       1.421100      -1.244800    
 H    4.294200     -0.1580000       1.633400    
 H    4.174700      -1.777200      0.9361000    
 H    4.436800      0.8506000      -2.262700    
 H    4.556500       2.453600      -1.540300    
 H    5.730400       1.556300      0.4238000    
 H    6.547000       1.054400      -1.061200    
 H    1.756000      0.1159000       1.597000    
 H    1.670200      -1.564900       1.005300    
 H    7.572400     -0.8216000      7.6300003E-02
 H    6.577500      -2.005200      0.9104000    
 H    6.783300     -0.3834000       1.607100    
 H   -1.262800      0.3529000      -1.357600    
 H   -5.710000      -1.927300     -0.6197000    
 H   -5.493000       2.115900      0.7653000    
 H   -2.494200      -2.098100      -1.982300    
 H   -3.817400      -3.073800      -1.349200    
 H   -2.421600      -2.744400     -0.3185000    
 H   -2.154600       2.258200       1.396900    
 H   -2.230300       2.773900     -0.3117000    
 H   -3.476100       3.281500      0.8258000    
 H   -6.815800      0.1067000      0.2268000    


%chk=000030374-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030374

0 1
O 0.610890 -0.123266 -0.082248
O -0.813990 -0.010699 1.793713
N 5.522487 -0.498095 0.097400
N -1.622841 -0.023064 -0.436214
C 3.039782 -0.231921 -0.020331
C 3.222851 1.023367 -0.906390
C 4.275896 -0.417894 0.892721
C 4.553796 0.945436 -1.685572
C 5.735299 0.720071 -0.722181
C 1.775695 -0.160873 0.841413
C 6.692855 -0.815557 0.938294
C -0.649867 -0.045310 0.550019
C -3.043641 0.002889 -0.220204
C -3.825086 -1.008916 -0.855371
C -3.648853 1.035616 0.554265
C -5.228964 -0.986580 -0.687654
C -5.057709 1.005874 0.712042
C -3.164611 -2.095575 -1.686116
C -2.840962 2.156006 1.175764
C -5.845683 0.008451 0.101669
H 2.971704 -1.122125 -0.676299
H 3.226986 1.924798 -0.256505
H 2.366440 1.125287 -1.596635
H 4.315095 0.431011 1.630721
H 4.178674 -1.354244 1.475842
H 4.516505 0.105013 -2.404942
H 4.719772 1.875326 -2.262592
H 5.858673 1.628814 -0.071847
H 6.675807 0.593570 -1.290795
H 1.755548 0.748227 1.472589
H 1.673220 -1.043290 1.501212
H 7.586921 -0.936570 0.300642
H 6.522646 -1.767897 1.472230
H 6.917469 -0.027111 1.701984
H -1.279343 -0.189659 -1.384802
H -5.836357 -1.762584 -1.168013
H -5.536357 1.790397 1.309725
H -2.734110 -1.700738 -2.629012
H -3.897064 -2.870728 -1.966463
H -2.341682 -2.584721 -1.132654
H -2.301765 1.801292 2.072712
H -2.074160 2.535646 0.474941
H -3.495631 2.996228 1.463128
H -6.933337 0.010298 0.232914


