%chk=000019898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019898

0 1
 O   -1.618100      -2.028600     -3.5999999E-03
 O    2.368700      -2.716900     -4.1999999E-03
 O   0.3124000      -3.485800     -4.4000000E-03
 O    1.407000       3.456000      3.9999999E-04
 O    3.133700       2.100400     -9.9999997E-05
 N    1.129400      -2.536600     -4.1000000E-03
 N    1.896600       2.302000     -3.9999999E-04
 C   -2.711400      0.5873000     -1.6000000E-03
 C   -1.197400      0.3188000     -1.8000000E-03
 C   -2.968900       2.109800     -6.0000003E-04
 C   -3.349600     -3.6400001E-02   1.258500    
 C   -3.450600      3.9999999E-04  -1.225500    
 C  -0.7465000     -0.9778000     -2.9000000E-03
 C  -0.3586000       1.406900     -1.0000000E-03
 C   0.6304000      -1.201800     -3.0000000E-03
 C    1.018000       1.183000     -1.2000001E-03
 C    1.512500     -0.1213000     -2.0999999E-03
 C    2.992400     -0.3593000     -2.3000001E-03
 H   -4.050200       2.303800      1.0600000E-02
 H   -2.580300       2.606300      0.8970000    
 H   -2.592900       2.606400     -0.9035000    
 H   -2.818300      0.2769000       2.165300    
 H   -4.391100      0.2916000       1.364700    
 H   -3.374500      -1.129100       1.250500    
 H   -4.506000      0.2976000      -1.229300    
 H   -3.000800      0.3607000      -2.158200    
 H   -3.431700      -1.092400      -1.258600    
 H  -0.6981000       2.432100     -1.9000000E-03
 H    3.225400      -1.037700      0.8289000    
 H    3.312100     -0.7631000     -0.9702000    
 H    3.758300      0.3504000      0.2776000    
 H   -1.232100      -2.780200     -0.4801000    


%chk=000019898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019898

0 1
O -1.648993 -2.031629 0.008980
O 2.322759 -2.898773 -0.562084
O 0.258724 -3.596926 0.047911
O 1.434745 3.412988 0.494834
O 3.086600 2.291561 -0.604041
N 1.130364 -2.620199 -0.190647
N 1.927206 2.340215 -0.035408
C -2.785949 0.633070 -0.007540
C -1.267800 0.341707 -0.017351
C -3.069841 2.158731 -0.020889
C -3.428611 0.037850 1.284201
C -3.453049 0.009790 -1.272840
C -0.754548 -0.999713 -0.016955
C -0.317187 1.367716 -0.021885
C 0.677304 -1.235067 -0.056472
C 1.081504 1.122158 -0.022042
C 1.645253 -0.173996 -0.010146
C 3.132558 -0.415797 0.161862
H -4.162881 2.316016 -0.017072
H -2.659996 2.669578 0.870289
H -2.669036 2.650880 -0.926789
H -2.986436 0.492270 2.190138
H -4.511897 0.258449 1.286471
H -3.298229 -1.054057 1.335300
H -4.536940 0.226754 -1.257760
H -3.031084 0.446948 -2.196786
H -3.320068 -1.082535 -1.305188
H -0.633791 2.411644 -0.008830
H 3.319764 -1.306485 0.781216
H 3.623948 -0.595318 -0.809914
H 3.618936 0.458303 0.616042
H -1.103533 -2.912734 0.076296


