%chk=000041577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041577

0 1
 O   -1.365400       1.744800     -1.8000000E-03
 O    4.295400      -1.654600      0.1188000    
 N  -0.3198000     -0.3289000      0.2443000    
 C   -2.770500     -0.1896000      0.3970000    
 C   -3.019200      -1.263600     -0.6938000    
 C   -2.774300     -0.8679000       1.781900    
 C   -3.909400      0.8509000      0.3876000    
 C   -1.412500      0.5307000      0.1885000    
 C   -3.014000     -0.7381000      -2.125400    
 C    1.049600     -3.9999999E-04  9.5799997E-02
 C    1.999800      -1.003600      0.1832000    
 C    1.408100       1.317100     -0.1343000    
 C    3.348400     -0.6800000      3.5900000E-02
 C    2.756800       1.640900     -0.2815000    
 C    3.726900      0.6423000     -0.1964000    
 H   -3.985300      -1.751600     -0.5101000    
 H   -2.264800      -2.056800     -0.6240000    
 H   -2.063200      -1.698800       1.838100    
 H   -2.504300     -0.1550000       2.569700    
 H   -3.764500      -1.273300       2.019800    
 H   -4.888400      0.3692000      0.4885000    
 H   -3.918200       1.440600     -0.5351000    
 H   -3.800600       1.560400       1.216700    
 H   -3.154400      -1.568600      -2.825200    
 H   -3.825800     -2.5800001E-02  -2.296600    
 H   -2.065700     -0.2523000      -2.373400    
 H  -0.5006000      -1.316000      0.4059000    
 H    1.702400      -2.033400      0.3641000    
 H   0.7230000       2.147300     -0.2141000    
 H    3.053100       2.670100     -0.4625000    
 H    4.776000      0.9007000     -0.3120000    
 H    3.857000      -2.507200      0.2826000    


%chk=000041577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041577

0 1
O -1.413109 1.823544 0.081623
O 4.317002 -1.711394 -0.004625
N -0.352840 -0.258540 0.225215
C -2.828787 -0.187931 0.433061
C -3.015193 -1.296715 -0.658487
C -2.834365 -0.855430 1.841698
C -3.979893 0.843043 0.361567
C -1.480929 0.567808 0.226562
C -2.929262 -0.806063 -2.119528
C 1.019632 0.091883 0.074925
C 1.962195 -0.973332 0.110598
C 1.467182 1.427121 -0.103992
C 3.339357 -0.698859 -0.032262
C 2.852778 1.667872 -0.244400
C 3.800163 0.625322 -0.211841
H -4.003607 -1.766555 -0.481146
H -2.270535 -2.107152 -0.503050
H -2.068483 -1.648614 1.939948
H -2.652967 -0.108543 2.635218
H -3.819872 -1.320784 2.028813
H -4.952164 0.325548 0.460525
H -3.965257 1.402104 -0.587920
H -3.889114 1.586642 1.171398
H -3.054949 -1.651040 -2.820844
H -3.715977 -0.065018 -2.344682
H -1.952208 -0.334228 -2.331053
H -0.536570 -1.257671 0.341314
H 1.617757 -2.008545 0.249829
H 0.740219 2.238960 -0.129926
H 3.198527 2.698115 -0.382760
H 4.872446 0.808829 -0.320086
H 3.904423 -2.600876 0.126506


