%chk=000031365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031365

0 1
 O   0.5967000      5.6200001E-02  -1.752500    
 O   0.6069000      -1.147300       1.573200    
 N   0.9332000      -2.245700     -0.4296000    
 C   0.9056000      0.1482000     -0.3558000    
 C  -0.2916000      0.8231000     -0.9398000    
 C   -1.669400      0.2482000     -0.8232000    
 C    2.103400      0.9864000     -7.7799998E-02
 C   0.7995000      -1.130700      0.3632000    
 C   -2.317800      0.5969000      0.5153000    
 C    2.035500       1.682700       1.284100    
 C   -3.701800     -1.7899999E-02  0.6430000    
 H  -0.2915000       1.898700      -1.059300    
 H   -1.653500     -0.8407000     -0.9534000    
 H   -2.281400      0.6473000      -1.641300    
 H    2.226100       1.756900     -0.8499000    
 H    3.007900      0.3673000     -0.1188000    
 H   -2.393000       1.686200      0.6162000    
 H   -1.693600      0.2490000       1.345100    
 H    1.127900       2.288900       1.369600    
 H    2.038400      0.9589000       2.104100    
 H    2.901300       2.339600       1.413700    
 H   -4.364600      0.3392000     -0.1516000    
 H   -3.652600      -1.109900      0.5856000    
 H   -4.149000      0.2517000       1.605000    
 H   0.8757000      -3.178300     -3.4400001E-02
 H    1.091600      -2.182000      -1.430100    


%chk=000031365-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031365

0 1
O 0.708051 0.063307 -1.907096
O 1.171961 -1.359532 1.525907
N 0.796983 -2.290643 -0.584579
C 1.024705 0.132182 -0.412490
C -0.260616 0.723869 -0.938166
C -1.634001 0.107137 -0.760365
C 2.170156 1.059994 -0.019000
C 0.996930 -1.232991 0.275888
C -2.340433 0.649101 0.510191
C 1.948813 1.736649 1.355220
C -3.764797 0.077588 0.671958
H -0.257713 1.820467 -1.044617
H -1.552908 -0.993691 -0.698369
H -2.249474 0.337938 -1.653042
H 2.262891 1.824839 -0.813601
H 3.118207 0.489926 -0.004961
H -2.388988 1.756097 0.463145
H -1.732211 0.395958 1.400332
H 1.019303 2.336321 1.359047
H 1.871723 0.976534 2.149313
H 2.790492 2.413124 1.589996
H -4.399422 0.336084 -0.196738
H -3.742189 -1.024825 0.757155
H -4.254007 0.475409 1.579408
H 0.790920 -3.242622 -0.220935
H 0.695523 -2.095320 -1.583002


