%chk=000049722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049722

0 1
 O   -1.496900       1.911200     -0.6680000    
 O    2.911000      -2.009500     -0.7542000    
 O    4.386100     -7.2600000E-02  0.5870000    
 C   -1.984200     -0.3937000     -0.5693000    
 C   -3.417300      6.1600000E-02 -0.8539000    
 C   -2.033700      -1.147000      0.7659000    
 C   -4.104900      3.4499999E-02  0.5031000    
 C   -3.504800      -1.192800       1.164400    
 C   -1.049100      0.7767000     -0.4931000    
 C   0.3769000      0.5506000     -0.2115000    
 C   0.9726000     -0.6329000     -0.6204000    
 C    1.101200       1.525000      0.4582000    
 C    2.324700     -0.8471000     -0.3532000    
 C    2.453300       1.311100      0.7254000    
 C    3.065100      0.1249000      0.3196000    
 H   -1.672700      -1.042100      -1.395000    
 H   -3.900900     -0.6787000      -1.505400    
 H   -3.527100       1.029600      -1.350400    
 H   -1.461700     -0.6395000       1.551500    
 H   -1.627400      -2.159800      0.6711000    
 H   -5.193100     -3.1399999E-02  0.4161000    
 H   -3.857500      0.9366000       1.074700    
 H   -3.641000      -1.191400       2.249700    
 H   -3.971400      -2.101600      0.7658000    
 H   0.4280000      -1.402300      -1.157900    
 H   0.6379000       2.452000      0.7846000    
 H    3.018100       2.076200       1.251500    
 H    3.846400      -1.988200     -0.4874000    
 H    4.733700      0.7043000       1.057900    


%chk=000049722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000049722

0 1
O -1.369027 2.162073 0.223459
O 2.821898 -2.228807 -0.411168
O 4.610761 -0.249528 0.002037
C -2.016092 -0.147327 -0.223271
C -3.424800 0.355587 -0.672000
C -2.281246 -0.940148 1.106711
C -4.470444 -0.410700 0.201623
C -3.675613 -1.563629 0.869276
C -0.991403 0.971287 -0.001861
C 0.475427 0.639248 -0.004040
C 0.965115 -0.679499 -0.215885
C 1.399545 1.696225 0.219179
C 2.346378 -0.930664 -0.204104
C 2.785815 1.450877 0.229585
C 3.255836 0.139115 0.017874
H -1.622342 -0.861184 -0.971342
H -3.574406 0.156851 -1.748360
H -3.492928 1.446321 -0.520202
H -2.327547 -0.230126 1.955326
H -1.493815 -1.681979 1.328954
H -5.328007 -0.777018 -0.390400
H -4.873662 0.260313 0.983257
H -4.143660 -1.927993 1.801766
H -3.588796 -2.424337 0.177141
H 0.295391 -1.525510 -0.390384
H 1.000250 2.701621 0.381462
H 3.494225 2.271338 0.399896
H 3.814397 -2.220789 -0.371194
H 5.220050 0.512079 0.153466


