%chk=000011977.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011977

0 1
 O    1.403800     -0.2503000     -2.1199999E-02
 O   0.4943000       1.821000      0.3296000    
 O   -2.043000      -2.004900      7.8500003E-02
 N  -0.8785000     -4.6999998E-02  0.2201000    
 N  -0.9057000      -1.523600      3.3100002E-02
 C   -2.128900      0.6671000      0.4286000    
 C   -2.736300       1.117000     -0.8840000    
 C    2.704500      0.3476000     -6.8300001E-02
 C   0.3534000      0.6075000      0.1880000    
 C    3.736500     -0.7345000     -0.3045000    
 H   -2.831800      5.1500000E-02  0.9999000    
 H   -1.921600       1.553400       1.039700    
 H   -2.049100       1.767100      -1.435600    
 H   -2.971800      0.2617000      -1.525600    
 H   -3.661600       1.673300     -0.7051000    
 H    2.740800       1.078000     -0.8841000    
 H    2.908400      0.8523000      0.8826000    
 H    4.744200     -0.3116000     -0.3461000    
 H    3.699600      -1.482900      0.4939000    
 H    3.534700      -1.261000      -1.243200    


%chk=000011977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000011977

0 1
O 1.406652 -0.291351 -0.019907
O 0.436777 1.814212 0.308782
O -2.074531 -2.026937 0.094994
N -0.900175 -0.108967 0.238100
N -0.904528 -1.528495 0.059283
C -2.149325 0.669996 0.435678
C -2.750906 1.157481 -0.898316
C 2.755468 0.370038 -0.088157
C 0.350364 0.568582 0.182080
C 3.766898 -0.749867 -0.293669
H -2.854936 -0.000584 0.955558
H -1.900193 1.523110 1.085967
H -2.049872 1.828845 -1.422551
H -2.998486 0.307915 -1.557020
H -3.680346 1.719490 -0.698280
H 2.739777 1.092945 -0.922886
H 2.913738 0.924105 0.853888
H 4.784636 -0.323486 -0.352698
H 3.736995 -1.466632 0.543856
H 3.563890 -1.298700 -1.228403


