%chk=000019816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019816

0 1
 O   -4.136700     -0.7322000     -8.4799998E-02
 N    3.260000      0.4615000      0.2996000    
 C   -1.956500      0.3050000      0.1104000    
 C    2.807200     -0.8823000     -3.6499999E-02
 C   -1.325500      -1.071400     -8.5400000E-02
 C    2.772000       1.431400     -0.6827000    
 C    4.721400      0.5097000      0.3766000    
 C   -3.477300      0.2962000      5.7999998E-02
 C    1.343200     -0.9503000     -5.6800000E-02
 C   0.1435000      -1.006500     -7.1800001E-02
 C   -4.151200       1.638900      0.1734000    
 H   -1.658000      0.7184000       1.081200    
 H   -1.601900      0.9889000     -0.6703000    
 H    3.172900      -1.593700      0.7145000    
 H    3.206200      -1.207800      -1.005900    
 H   -1.662700      -1.500800      -1.036500    
 H   -1.670900      -1.751500      0.7024000    
 H    1.682400       1.536000     -0.6554000    
 H    3.075700       1.176000      -1.704900    
 H    3.165600       2.429700     -0.4566000    
 H    5.058400       1.507400      0.6793000    
 H    5.194900      0.2605000     -0.5800000    
 H    5.089900     -0.1884000       1.136600    
 H   -3.870200       2.109700       1.118600    
 H   -5.236900       1.510000      0.1534000    
 H   -3.853900       2.271400     -0.6667000    


%chk=000019816-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019816

0 1
O -4.171341 -0.548517 -0.808739
N 3.423340 0.656482 0.021977
C -2.172275 0.312961 0.298220
C 2.719113 -0.613747 0.349122
C -1.350402 -0.628044 -0.615945
C 3.378512 0.976523 -1.419082
C 4.801251 0.646180 0.552135
C -3.672418 0.281856 -0.002669
C 1.285924 -0.599262 -0.000119
C 0.084776 -0.621509 -0.284339
C -4.531145 1.318472 0.713795
H -2.026896 0.031265 1.361480
H -1.806180 1.355976 0.220719
H 2.824053 -0.783094 1.439041
H 3.200290 -1.493604 -0.158157
H -1.500911 -0.331482 -1.671596
H -1.759991 -1.652740 -0.537196
H 2.327937 1.019294 -1.752159
H 3.915810 0.225896 -2.054564
H 3.838655 1.965870 -1.589940
H 5.275754 1.624958 0.361994
H 5.450930 -0.145203 0.095290
H 4.781450 0.484056 1.645133
H -4.206914 1.463195 1.759996
H -5.591876 1.024159 0.682572
H -4.425848 2.295856 0.202732


