%chk=000115488.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115488

0 1
 O   2.1100000E-02   2.547900      0.8638000    
 O    4.132300      -1.733900     -3.1399999E-02
 N   -2.291500      9.4499998E-02 -0.5974000    
 C   0.5899000      0.5745000     -0.3720000    
 C    1.921800       1.205500     -0.8013000    
 C   0.7727000     -0.2930000      0.8811000    
 C    3.007200      0.1506000     -0.9941000    
 C    1.861400      -1.343600      0.6838000    
 C  -0.4650000       1.652800     -0.1321000    
 C    3.183500     -0.7118000      0.2531000    
 C   -1.771000       1.039300      0.3554000    
 C   -3.541000     -0.5069000     -0.1316000    
 C   -3.324700      -1.211700       1.201300    
 C   -4.096600      -1.464200      -1.178600    
 H   0.2605000     -7.7100001E-02  -1.192600    
 H    2.269500       1.926700     -5.1300000E-02
 H    1.787500       1.760900      -1.737300    
 H  -0.1411000     -0.8378000       1.134000    
 H    1.031900      0.3276000       1.747800    
 H    2.759600     -0.4863000      -1.853400    
 H    3.958900      0.6326000      -1.248600    
 H    2.006700      -1.911700       1.610700    
 H    1.540900      -2.078600     -6.6299997E-02
 H  -0.6267000       2.230600      -1.050500    
 H    3.586900     -9.8099999E-02   1.067400    
 H   -1.621100      0.6395000       1.362000    
 H   -2.492000       1.857500      0.4929000    
 H   -2.440400      0.5479000      -1.498300    
 H  -0.6521000       3.237600      0.9927000    
 H    4.234900      -2.270400      0.7731000    
 H   -4.290700      0.2824000      1.1100000E-02
 H   -4.196600      -1.828800       1.449500    
 H   -2.456800      -1.880100       1.173300    
 H   -3.206000     -0.5132000       2.035200    
 H   -4.275000     -0.9482000      -2.128600    
 H   -5.050600      -1.890400     -0.8500000    
 H   -3.405500      -2.293100      -1.369000    


%chk=000115488-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115488

0 1
O 0.071299 2.612679 0.862627
O 4.357169 -1.681095 -0.025058
N -2.426019 0.138148 -0.529807
C 0.615749 0.498575 -0.214345
C 1.874143 1.053795 -0.932562
C 1.005425 -0.146025 1.141353
C 2.966630 -0.026359 -1.104481
C 2.099049 -1.225613 0.952092
C -0.458129 1.596873 -0.073677
C 3.342154 -0.642461 0.249761
C -1.834572 1.094654 0.424217
C -3.705079 -0.506768 -0.123674
C -3.465298 -1.525294 1.012889
C -4.316536 -1.199303 -1.358513
H 0.159159 -0.289427 -0.849773
H 2.268656 1.906934 -0.346968
H 1.590745 1.452876 -1.927359
H 0.120785 -0.611042 1.616897
H 1.363434 0.647341 1.825205
H 2.604326 -0.840346 -1.763565
H 3.870885 0.399901 -1.577134
H 2.382269 -1.651838 1.937353
H 1.710059 -2.058804 0.332702
H -0.602633 2.066998 -1.077514
H 3.781382 0.147845 0.901887
H -1.702304 0.602191 1.403055
H -2.490859 1.989654 0.604810
H -2.511844 0.556757 -1.467686
H -0.597875 3.336680 0.962146
H 4.578346 -2.138774 0.826085
H -4.436984 0.257351 0.246156
H -4.411711 -2.027966 1.284561
H -2.736885 -2.287438 0.682572
H -3.070791 -1.042790 1.925063
H -4.517122 -0.473073 -2.170181
H -5.272343 -1.688129 -1.100049
H -3.621881 -1.967208 -1.745286


