%chk=000082322.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082322

0 1
 O  -0.4273000      0.6701000      0.2152000    
 O   0.8547000      -1.116700      0.8776000    
 N    1.752300      0.6556000     -0.3205000    
 C   -1.627900     -0.1101000      0.1912000    
 C   -2.828400      0.8207000      0.1153000    
 C   -1.578400      -1.068800     -0.9888000    
 C   0.7395000     -3.4600001E-02  0.3115000    
 C    3.115500      0.1837000     -0.4013000    
 H   -1.698700     -0.6769000       1.127900    
 H   -3.768800      0.2612000      0.1165000    
 H   -2.830100       1.510300      0.9662000    
 H   -2.787400       1.437900     -0.7890000    
 H   -1.373000     -0.5306000      -1.921100    
 H   -2.529700      -1.599800      -1.099500    
 H  -0.7961000      -1.825700     -0.8809000    
 H    1.527300       1.545300     -0.7550000    
 H    3.378300      8.0300003E-02  -1.456800    
 H    3.235300     -0.7760000      0.1068000    
 H    3.763500      0.9323000      6.0899999E-02


%chk=000082322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082322

0 1
O -0.396537 0.566142 -0.300233
O 0.910418 -1.182537 0.615439
N 1.866144 0.720713 -0.385192
C -1.648634 -0.189937 0.043906
C -2.736992 0.877606 0.182547
C -1.929747 -1.227891 -1.052488
C 0.816924 -0.071055 0.029386
C 3.262484 0.336257 -0.172061
H -1.463391 -0.702514 1.006439
H -3.695332 0.404273 0.463206
H -2.467692 1.612606 0.960206
H -2.880240 1.414697 -0.771868
H -2.044742 -0.733496 -2.033786
H -2.863523 -1.775460 -0.826573
H -1.107057 -1.960193 -1.110707
H 1.633080 1.601798 -0.843042
H 3.806294 0.242844 -1.130713
H 3.268388 -0.642779 0.333099
H 3.790756 1.067125 0.468634


