%chk=000061985.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061985

0 1
 O   -1.775400     -0.2622000     -4.0000002E-03
 O  -0.4697000      -2.146600     -0.2579000    
 O   -4.235400      0.7908000     -0.8838000    
 C    4.430300     -0.2937000     -1.5900001E-02
 C    3.066900      0.3903000      0.1045000    
 C    5.572700      0.7114000      0.1413000    
 C    1.924300     -0.6121000     -8.6300001E-02
 C    6.934200      3.4200002E-02 -1.2100000E-02
 C   0.5482000      4.7600001E-02  7.9999998E-04
 C    8.071500       1.035700      0.1100000    
 C  -0.5935000     -0.9379000     -0.1153000    
 C   -2.955500      -1.070100     -6.3400000E-02
 C   -4.126100     -0.1476000      7.5999998E-02
 C   -5.119700     -6.6200003E-02  0.9961000    
 C   -5.926300       1.019300      0.5791000    
 C   -5.346500       1.506900     -0.5689000    
 H    4.519400      -1.075300      0.7483000    
 H    4.507800     -0.7861000     -0.9929000    
 H    2.978000      0.8666000       1.088300    
 H    2.985000       1.183600     -0.6485000    
 H    5.508300       1.191600       1.125300    
 H    5.470600       1.502700     -0.6115000    
 H    2.026700      -1.108500      -1.059600    
 H    2.001200      -1.399600      0.6740000    
 H    6.996600     -0.4610000     -0.9881000    
 H    7.052400     -0.7414000      0.7535000    
 H   0.4516000      0.5606000      0.9646000    
 H   0.4450000      0.7846000     -0.8037000    
 H    8.057200       1.528100       1.087500    
 H    8.000700       1.806300     -0.6644000    
 H    9.035600      0.5298000     -1.5000000E-03
 H   -2.946300      -1.800800      0.7531000    
 H   -3.005100      -1.589600      -1.026900    
 H   -5.262200     -0.6969000       1.861800    
 H   -6.818600       1.398900       1.055500    
 H   -5.588700       2.314700      -1.244100    


%chk=000061985-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061985

0 1
O -1.793352 -0.219649 0.096481
O -0.549434 -1.879713 -0.968425
O -4.611433 0.718933 -0.918175
C 4.484737 -0.288380 0.047585
C 3.116155 0.427162 -0.008015
C 5.683400 0.685244 0.101664
C 1.928603 -0.556168 -0.092738
C 7.051043 -0.033168 0.158921
C 0.567359 0.169904 -0.129811
C 8.244997 0.944841 0.201373
C -0.598565 -0.770175 -0.388317
C -3.034477 -1.032501 -0.184543
C -4.222914 -0.193503 0.091729
C -5.104205 -0.093276 1.158323
C -6.082763 0.917534 0.818403
C -5.749790 1.386343 -0.441493
H 4.513968 -0.955863 0.934151
H 4.588061 -0.947271 -0.839809
H 3.004723 1.073656 0.887796
H 3.094899 1.106124 -0.886512
H 5.581633 1.347271 0.987346
H 5.657544 1.350184 -0.787149
H 2.023730 -1.188505 -0.995576
H 1.954607 -1.247128 0.773058
H 7.148574 -0.699451 -0.722597
H 7.078468 -0.692678 1.050418
H 0.374435 0.731991 0.801426
H 0.566827 0.920819 -0.947206
H 8.187347 1.603167 1.088976
H 8.257409 1.593212 -0.695198
H 9.209829 0.406496 0.242429
H -3.017399 -1.918703 0.472014
H -2.989705 -1.368982 -1.234852
H -5.055918 -0.670378 2.079884
H -6.920037 1.249468 1.428677
H -6.173156 2.131244 -1.109339


