%chk=000031209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031209

0 1
 O    1.817800       3.498300     -4.4000000E-03
 C    1.930200     -1.8100001E-02 -0.1905000    
 C    2.829800      -1.044600      0.5065000    
 C    1.055700      0.8274000      0.7474000    
 C    3.677700      -1.860400     -0.4708000    
 C   0.1398000       1.791100      3.4499999E-02
 C    4.558500      -2.861300      0.2607000    
 C   -1.122100       1.575900     -0.3787000    
 C   -1.879900      0.3324000     -0.2014000    
 C   0.6839000       3.139100     -0.2995000    
 C   -1.837100     -0.6426000      -1.189300    
 C   -2.630500      0.1460000      0.9522000    
 C   -2.557800      -1.825000      -1.021000    
 C   -3.351200      -1.036400       1.120500    
 C   -3.314700      -2.021900      0.1338000    
 H    2.560500      0.6530000     -0.7884000    
 H    1.285500     -0.5481000     -0.9027000    
 H    3.487600     -0.5215000       1.211400    
 H    2.204000      -1.723000       1.099500    
 H   0.4596000      0.1518000       1.373600    
 H    1.695800       1.374100       1.451100    
 H    3.025500      -2.395900      -1.170300    
 H    4.309200      -1.189100      -1.064000    
 H    3.953700      -3.566600      0.8396000    
 H    5.156100      -3.434200     -0.4553000    
 H    5.244500      -2.353100      0.9460000    
 H   -1.680600       2.351300     -0.8996000    
 H   3.9999999E-04   3.817900     -0.8375000    
 H   -1.251700     -0.5019000      -2.094400    
 H   -2.667700      0.9058000       1.728600    
 H   -2.529500      -2.592400      -1.789100    
 H   -3.940600      -1.190000       2.019700    
 H   -3.875800      -2.942500      0.2650000    


%chk=000031209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031209

0 1
O 1.910253 3.367352 -0.611837
C 2.061246 -0.111046 -0.151783
C 2.963943 -0.893162 0.827888
C 1.098772 0.866981 0.582940
C 3.949144 -1.845900 0.113137
C 0.207376 1.646215 -0.361199
C 4.849546 -2.627515 1.094378
C -1.069413 1.337872 -0.790709
C -1.946074 0.193716 -0.506353
C 0.763470 2.916410 -0.891799
C -3.330149 0.330711 -0.834794
C -1.514506 -1.049067 0.049800
C -4.249276 -0.708242 -0.592543
C -2.434116 -2.091066 0.284510
C -3.804577 -1.926753 -0.027290
H 2.691943 0.474310 -0.848442
H 1.481740 -0.822416 -0.775227
H 3.535677 -0.173961 1.450012
H 2.333149 -1.478731 1.530497
H 0.499125 0.318219 1.332595
H 1.726304 1.597141 1.128952
H 3.377497 -2.559223 -0.515435
H 4.581735 -1.257589 -0.582151
H 4.244389 -3.251408 1.779217
H 5.548178 -3.295515 0.557772
H 5.451522 -1.936902 1.714469
H -1.535501 2.093493 -1.446893
H 0.084606 3.477640 -1.585508
H -3.680168 1.272202 -1.276327
H -0.457936 -1.214464 0.269226
H -5.306233 -0.573776 -0.846812
H -2.081048 -3.039403 0.704637
H -4.514017 -2.740623 0.158270


