%chk=000071651.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071651

0 1
 O   0.1254000       2.238200     -0.2172000    
 O   -3.615300      -1.020400      -1.626600    
 O   -3.267300      -1.619900      0.5355000    
 N  -0.8325000      0.4188000      0.8563000    
 C   -2.131500       1.002500       1.056400    
 C   -3.070600      0.7223000     -0.1094000    
 C    1.477500      0.3445000      7.3299997E-02
 C   0.2048000       1.095600      0.2261000    
 C    2.322100      0.6677000     -0.9684000    
 C    1.774800     -0.6520000      0.9798000    
 C   -3.316800     -0.7549000     -0.3277000    
 C    3.517500     -3.6899999E-02  -1.109800    
 C    2.970300      -1.356600      0.8383000    
 C    3.841700      -1.049100     -0.2065000    
 H   -2.532600      0.5822000       1.984800    
 H   -2.024800       2.084000       1.193700    
 H   -2.639900       1.140500      -1.027100    
 H   -4.040100       1.200600      6.4599998E-02
 H  -0.7255000     -0.5508000       1.133700    
 H    2.082400       1.449300      -1.683000    
 H    1.142400     -0.8983000       1.826100    
 H    4.195800      0.2019000      -1.923800    
 H    3.227000      -2.139300       1.546200    
 H    4.773300      -1.596600     -0.3156000    
 H   -3.779200      -1.976000      -1.775800    


%chk=000071651-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071651

0 1
O 0.237658 2.359482 -0.208898
O -4.558627 -1.235801 -0.888430
O -2.788834 -1.666353 0.544234
N -0.840354 0.478413 0.628948
C -2.139378 1.148398 0.749092
C -3.167810 0.638328 -0.284623
C 1.561803 0.339705 0.084083
C 0.282503 1.138855 0.156118
C 2.639329 0.914287 -0.637771
C 1.741890 -0.925726 0.703180
C -3.446696 -0.844882 -0.140426
C 3.868486 0.233576 -0.753977
C 2.974189 -1.605980 0.589260
C 4.039132 -1.031201 -0.142638
H -2.535181 1.005024 1.772031
H -1.960767 2.224555 0.587649
H -2.797420 0.820434 -1.311810
H -4.122655 1.188202 -0.195238
H -0.829541 -0.523767 0.828762
H 2.483020 1.898721 -1.090899
H 0.944349 -1.385060 1.299142
H 4.692253 0.686060 -1.316886
H 3.105207 -2.578939 1.075518
H 4.994144 -1.561390 -0.229575
H -4.697797 -2.217639 -0.792948


