%chk=000089213.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089213

0 1
 O    1.611700      0.1447000     -0.1598000    
 O   -1.254000      0.5855000     -0.3823000    
 O   -1.704600      -1.011600       1.219600    
 C  -0.1216000      -1.477400     -0.5695000    
 C    1.283800      -1.233200     -2.4400000E-02
 C  -0.5008000      -2.952900     -0.4735000    
 C   -1.124700     -0.6394000      0.2075000    
 C    2.930000      0.4130000      0.2965000    
 C   -2.154600       1.490000      0.2649000    
 C    3.219400       1.889200      0.1276000    
 C   -2.184700       2.792100     -0.5066000    
 H  -0.1763000      -1.173200      -1.622500    
 H    1.336500      -1.510800       1.035700    
 H    2.008500      -1.838200     -0.5825000    
 H  -0.4468000      -3.317100      0.5586000    
 H   -1.524300      -3.115800     -0.8286000    
 H   0.1709000      -3.565600      -1.083700    
 H    3.019500      0.1385000       1.353500    
 H    3.650700     -0.1723000     -0.2853000    
 H   -3.158100       1.050900      0.2897000    
 H   -1.812500       1.674600       1.289300    
 H    4.228800       2.131900      0.4712000    
 H    3.123300       2.183100     -0.9229000    
 H    2.499300       2.490300      0.6928000    
 H   -2.864500       3.509000     -3.7799999E-02
 H   -1.183800       3.233600     -0.5558000    
 H   -2.507600       2.621100      -1.538800    


%chk=000089213-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089213

0 1
O 2.051098 0.066999 -0.182747
O -1.582428 0.643016 -0.472314
O -0.878416 -0.308530 1.533703
C 0.015413 -1.159253 -0.612604
C 1.439061 -1.257012 -0.044711
C -0.650146 -2.559282 -0.693972
C -0.824675 -0.250483 0.282417
C 3.339284 0.172961 0.517447
C -2.466504 1.570827 0.300473
C 3.870966 1.587664 0.290146
C -3.171725 2.458381 -0.719773
H 0.061632 -0.706974 -1.618119
H 1.396938 -1.559081 1.024534
H 2.025208 -2.014788 -0.610860
H -0.716154 -3.021304 0.307437
H -1.670487 -2.486008 -1.108938
H -0.061449 -3.225428 -1.350140
H 3.190940 -0.029646 1.601438
H 4.048809 -0.588001 0.120155
H -3.171622 0.963925 0.897362
H -1.832766 2.146412 0.998999
H 4.840215 1.724626 0.803558
H 4.012744 1.778219 -0.787668
H 3.157032 2.332497 0.681882
H -3.837476 3.171381 -0.199777
H -2.439610 3.033670 -1.311653
H -3.782382 1.855210 -1.413373


