%chk=000070834.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070834

0 1
 O  -0.5004000       1.031100     -0.6923000    
 O    5.046000      -1.761200      4.4300001E-02
 O    5.654100      0.2596000      0.8885000    
 C   -3.915600     -0.4278000     -0.1220000    
 C   -5.282600      0.1533000      0.2498000    
 C   -2.814700      0.6268000     -0.2249000    
 C   -6.378900     -0.9052000      0.3768000    
 C   -1.483300      7.0000002E-03 -0.6282000    
 C   -7.729300     -0.2713000      0.6753000    
 C   0.7935000      0.6641000     -0.4276000    
 C    1.667900       1.585900      0.1359000    
 C    1.217300     -0.6258000     -0.7256000    
 C    3.417600     -7.9999998E-02  0.1097000    
 C    2.984600       1.212600      0.4054000    
 C    2.533900     -0.9992000     -0.4559000    
 C    4.790200     -0.4699000      0.3910000    
 H   -4.001900     -0.9561000      -1.079700    
 H   -3.630000      -1.176400      0.6274000    
 H   -5.196200      0.6984000       1.198000    
 H   -5.574100      0.8879000     -0.5114000    
 H   -2.701100       1.148900      0.7333000    
 H   -3.094200       1.396200     -0.9551000    
 H   -6.449700      -1.479600     -0.5540000    
 H   -6.122800      -1.610500       1.175700    
 H   -1.228100     -0.7533000      0.1216000    
 H   -1.572700     -0.4672000      -1.612500    
 H   -8.498900      -1.044400      0.7649000    
 H   -7.700000      0.2897000       1.614800    
 H   -8.027300      0.4133000     -0.1253000    
 H    1.334300       2.593300      0.3679000    
 H   0.5694000      -1.361500      -1.192200    
 H    3.657400       1.943500      0.8463000    
 H    2.831100      -2.013400     -0.7078000    
 H    5.973700      -2.014300      0.2385000    


%chk=000070834-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070834

0 1
O -0.484296 0.862489 0.192009
O 5.410826 -1.613165 -0.493285
O 5.985857 0.591426 -0.042087
C -4.050651 -0.492688 0.028468
C -5.431561 0.180159 0.197875
C -2.878538 0.504486 0.181892
C -6.611260 -0.808929 0.057493
C -1.521168 -0.177401 0.006157
C -7.987107 -0.129402 0.227994
C 0.854749 0.491397 0.077151
C 1.794611 1.539567 0.273652
C 1.303011 -0.825285 -0.213901
C 3.628344 -0.042108 -0.111854
C 3.166516 1.272729 0.179566
C 2.684585 -1.081821 -0.306410
C 5.086311 -0.272323 -0.200534
H -4.001538 -0.976349 -0.969663
H -3.948323 -1.306678 0.776407
H -5.482138 0.670041 1.192499
H -5.540935 0.989485 -0.553532
H -2.914606 0.979057 1.181116
H -2.972384 1.316767 -0.563925
H -6.560069 -1.299063 -0.936253
H -6.500328 -1.616954 0.809216
H -1.375911 -0.978666 0.760032
H -1.422848 -0.617326 -1.007782
H -8.813706 -0.855409 0.120477
H -8.076926 0.339395 1.226094
H -8.133682 0.664143 -0.528838
H 1.420009 2.542808 0.496541
H 0.593332 -1.642702 -0.367447
H 3.904697 2.067387 0.328170
H 3.043124 -2.090422 -0.530076
H 6.401205 -1.690145 -0.536620


