%chk=000117255.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117255

0 1
 O   -3.746600      0.5389000     -0.2886000    
 O   -2.504300      -1.263700     -0.9234000    
 O    3.413100      0.9701000     -0.4349000    
 N    1.345200      8.0799997E-02  0.1471000    
 C   -1.577000      0.3708000      0.5986000    
 C  -0.7381000     -0.7382000       1.243600    
 C  -0.7367000       1.360600     -0.2164000    
 C   0.4970000      -1.087400      0.4162000    
 C   0.7128000       1.397500      0.2532000    
 C   -2.629300     -0.2284000     -0.2864000    
 C    2.693200     -4.9000001E-03 -0.2071000    
 C    3.270800      -1.396000     -0.3018000    
 H   -2.088200      0.8987000       1.414700    
 H   -1.333600      -1.641100       1.423600    
 H  -0.4022000     -0.3898000       2.229600    
 H   -1.176500       2.362200     -0.1385000    
 H  -0.7573000       1.099300      -1.283000    
 H    1.078900      -1.849600      0.9432000    
 H   0.2096000      -1.506800     -0.5546000    
 H    1.275700       2.132900     -0.3315000    
 H   0.7719000       1.704300       1.304300    
 H    4.272400      -1.343600     -0.7395000    
 H    2.654200      -2.028600     -0.9454000    
 H    3.352300      -1.834300      0.6962000    
 H   -4.447200      0.1641000     -0.8639000    


%chk=000117255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117255

0 1
O -3.687543 0.788326 -0.440544
O -2.931826 -1.404144 -0.520531
O 3.397947 1.092540 -0.300139
N 1.362152 0.073354 0.167388
C -1.589135 0.331081 0.651300
C -0.701742 -0.802357 1.236600
C -0.752659 1.291796 -0.267258
C 0.505038 -1.126966 0.333622
C 0.695830 1.398685 0.239009
C -2.764054 -0.224339 -0.138810
C 2.718425 0.027450 -0.142515
C 3.355989 -1.355645 -0.278059
H -2.012239 0.935409 1.475501
H -1.300947 -1.720002 1.368894
H -0.329510 -0.496689 2.231378
H -1.225050 2.288097 -0.295061
H -0.737523 0.910271 -1.305779
H 1.095024 -1.938165 0.792755
H 0.144045 -1.497924 -0.648615
H 1.291346 2.097548 -0.372792
H 0.716075 1.786413 1.278720
H 4.376679 -1.214484 -0.662523
H 2.796292 -2.012984 -0.967373
H 3.419200 -1.866390 0.701341
H -4.431714 0.406920 -0.981207


