%chk=000038345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038345

0 1
 O  -0.4345000      0.3340000     -0.7583000    
 O   -1.565300      -1.420900      -1.728200    
 N    1.741200      -2.530400      2.6300000E-02
 C   0.7056000      -1.526200      0.2824000    
 C   0.8091000     -0.3720000     -0.7307000    
 C   0.7792000     -0.9825000       1.715000    
 C    2.073500     -0.2147000       1.983700    
 C    1.883400      0.6410000     -0.4087000    
 C    2.449200      0.7372000      0.8763000    
 C    2.299200       1.534600      -1.409800    
 C    3.433800       1.706600       1.125100    
 C    1.641600      -3.025600      -1.345300    
 C    1.627700      -3.632600      0.9794000    
 C    3.271400       2.498800      -1.146600    
 C    3.839600       2.583900      0.1204000    
 C   -1.532400     -0.4160000      -1.035000    
 C   -2.731200      0.1546000     -0.3704000    
 C   -3.748900     -0.6947000      1.2600000E-02
 C   -2.790500       1.516500     -0.1567000    
 C   -4.875400     -0.1588000      0.6367000    
 C   -3.916900       2.052400      0.4674000    
 C   -4.959300       1.214800      0.8642000    
 H  -0.2640000      -2.031700      0.2122000    
 H   0.9655000     -0.7078000      -1.758800    
 H   0.6279000      -1.752600       2.478300    
 H  -6.2100001E-02 -0.2887000       1.856900    
 H    2.900000     -0.9225000       2.121300    
 H    1.959600      0.3405000       2.922800    
 H    1.863100       1.483500      -2.404700    
 H    3.892000       1.780400       2.108500    
 H    2.061500      -2.323500      -2.071200    
 H   0.6169000      -3.289100      -1.630700    
 H    2.252300      -3.928800      -1.471200    
 H   0.6211000      -4.065600       1.005500    
 H    1.919000      -3.335600       1.991200    
 H    2.326000      -4.437500      0.7181000    
 H    3.584700       3.182100      -1.930400    
 H    4.599900       3.331400      0.3267000    
 H   -3.693100      -1.766100     -0.1555000    
 H   -1.999100       2.191800     -0.4676000    
 H   -5.686800     -0.8109000      0.9465000    
 H   -3.983900       3.122300      0.6419000    
 H   -5.836600       1.632300       1.349700    


%chk=000038345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038345

0 1
O -0.624676 0.069489 -0.028033
O -1.713383 -1.319540 -1.563112
N 2.021212 -2.638870 0.140858
C 0.912680 -1.750870 0.596733
C 0.697285 -0.578908 -0.396039
C 1.194339 -1.129563 1.986583
C 2.512721 -0.330288 1.973664
C 1.748246 0.508926 -0.325466
C 2.591343 0.649895 0.810866
C 1.876302 1.408317 -1.412983
C 3.538896 1.703222 0.828911
C 1.827325 -3.170163 -1.231072
C 2.281329 -3.743318 1.092726
C 2.823214 2.452209 -1.385751
C 3.659305 2.600176 -0.253451
C -1.755510 -0.401478 -0.703341
C -2.993214 0.322426 -0.287196
C -4.225235 -0.073979 -0.869627
C -2.963933 1.380665 0.658155
C -5.419368 0.582850 -0.509188
C -4.161769 2.035366 1.014889
C -5.389915 1.638288 0.433952
H -0.049815 -2.323367 0.640704
H 0.564222 -0.948589 -1.425860
H 1.217346 -1.902418 2.774524
H 0.346390 -0.458677 2.220329
H 3.361861 -1.036890 1.881884
H 2.644055 0.208852 2.931457
H 1.221732 1.287200 -2.285337
H 4.190754 1.817308 1.704332
H 1.917002 -2.369012 -1.983171
H 0.839893 -3.674012 -1.371763
H 2.624065 -3.904158 -1.443034
H 1.388376 -4.396889 1.264204
H 2.609927 -3.351862 2.069755
H 3.096169 -4.374736 0.697501
H 2.911623 3.140620 -2.233241
H 4.398940 3.408150 -0.216932
H -4.221491 -0.891937 -1.597695
H -2.006798 1.679737 1.094186
H -6.369459 0.276347 -0.959903
H -4.139621 2.854186 1.742164
H -6.318363 2.149194 0.713117


