%chk=000117782.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117782

0 1
 O    3.914800     -0.9875000      0.3614000    
 O    3.394600       1.032800     -0.5482000    
 N  -0.7263000      0.2472000      0.2830000    
 C   -1.092500     -0.9746000     -0.4470000    
 C   -1.682500       1.331300      1.7600000E-02
 C   -2.491400      -1.453400     -5.5199999E-02
 C   -3.100600      0.9279000      0.4245000    
 C   -3.531500     -0.3597000     -0.2686000    
 C   0.6309000      0.6652000     -6.7299999E-02
 C    1.635000     -0.4173000      0.3170000    
 C    3.049400     -1.2000000E-02 -1.7200001E-02
 H  -0.4339000      -1.812500     -0.2052000    
 H   -1.045500     -0.8151000      -1.532300    
 H   -1.670400       1.611900      -1.044000    
 H   -1.403900       2.222300      0.5934000    
 H   -2.494500      -1.759400      0.9989000    
 H   -2.759900      -2.337200     -0.6451000    
 H   -3.800500       1.733600      0.1756000    
 H   -3.145500      0.7900000       1.512400    
 H   -3.652600     -0.1742000      -1.342900    
 H   -4.504800     -0.6857000      0.1142000    
 H   0.7130000      0.8966000      -1.137800    
 H   0.8861000       1.584400      0.4759000    
 H    1.477100      -1.344600     -0.2405000    
 H    1.580300     -0.6222000       1.392300    
 H    4.844600     -0.7511000      0.1567000    


%chk=000117782-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117782

0 1
O 4.058311 -0.934678 0.375445
O 3.468468 1.272398 -0.030122
N -0.719177 0.172191 0.137573
C -1.207908 -1.041381 -0.569525
C -1.666266 1.307239 -0.033225
C -2.595450 -1.470638 -0.050863
C -3.066279 0.951760 0.507226
C -3.613955 -0.316565 -0.185618
C 0.658486 0.551327 -0.255627
C 1.703853 -0.443596 0.284535
C 3.116845 0.090254 0.179306
H -0.485992 -1.863363 -0.413435
H -1.268581 -0.857406 -1.676525
H -1.755915 1.598181 -1.114225
H -1.259281 2.180545 0.510045
H -2.502879 -1.759621 1.013880
H -2.936269 -2.361726 -0.612521
H -3.748204 1.809666 0.350626
H -2.992272 0.775455 1.597782
H -3.787855 -0.102517 -1.260840
H -4.589693 -0.606223 0.248132
H 0.770852 0.646356 -1.366022
H 0.878246 1.547330 0.168821
H 1.667656 -1.423338 -0.223015
H 1.488318 -0.639350 1.353908
H 4.974442 -0.545600 0.335886


