%chk=000081255.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081255

0 1
 O   -1.675500     -0.7817000      0.3935000    
 O    1.761500     -0.6692000     -0.1935000    
 O  -0.9227000     -0.7103000      -1.789500    
 O    1.868800       1.075400       1.317700    
 C  -0.4670000       2.060000     -0.1415000    
 C  -4.2399999E-02  0.7757000     -0.1133000    
 C   0.3451000       3.231400      0.3622000    
 C   -1.810500       2.495900     -0.6807000    
 C  -0.9163000     -0.3138000     -0.6342000    
 C    1.302200      0.4449000      0.4383000    
 C   -2.567400      -1.850600      6.1999999E-02
 C    3.046100      -1.132600      0.2341000    
 C   -3.334700      -2.255500       1.302600    
 C    3.412800      -2.369600     -0.5578000    
 H   2.3800001E-02   4.163300     -0.1173000    
 H   0.2130000       3.350900       1.442100    
 H    1.409000       3.134500      0.1269000    
 H   -2.439700       1.664800      -1.010200    
 H   -1.674100       3.161900      -1.539400    
 H   -2.367100       3.035700      9.3099996E-02
 H   -3.266200      -1.515800     -0.7128000    
 H   -1.991200      -2.704200     -0.3122000    
 H    3.792500     -0.3488000      6.3500002E-02
 H    3.010000      -1.374100       1.302300    
 H   -4.027900      -3.072600       1.084600    
 H   -2.647800      -2.575600       2.093000    
 H   -3.901700      -1.406700       1.698900    
 H    4.391700      -2.751900     -0.2553000    
 H    2.665100      -3.156200     -0.4115000    
 H    3.435300      -2.148000      -1.629900    


%chk=000081255-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081255

0 1
O -1.414977 -0.943948 0.399321
O 1.376343 -0.610060 -0.082094
O -2.028555 0.153983 -1.559318
O 1.562891 1.045922 1.542896
C -0.467911 2.448832 -0.272790
C -0.286701 1.094008 -0.087835
C 0.553760 3.485001 0.149716
C -1.706180 3.039253 -0.916831
C -1.310338 0.094975 -0.529255
C 0.944556 0.548417 0.568123
C -2.353549 -2.048523 0.041350
C 2.556272 -1.297396 0.521428
C -2.246579 -3.090643 1.149923
C 2.812540 -2.545633 -0.316677
H 0.614271 4.280995 -0.615953
H 0.224196 3.968283 1.090732
H 1.553281 3.069324 0.337957
H -2.566147 2.355260 -0.929746
H -1.488222 3.298960 -1.971728
H -1.979210 3.979811 -0.403280
H -3.371526 -1.627050 -0.047806
H -2.059578 -2.445893 -0.947233
H 3.411700 -0.597429 0.512378
H 2.317672 -1.532777 1.574713
H -2.926380 -3.935988 0.937392
H -1.216993 -3.481046 1.223411
H -2.524197 -2.657683 2.126099
H 3.681121 -3.096832 0.087731
H 1.936088 -3.216050 -0.301298
H 3.027052 -2.278874 -1.365624


