%chk=000086529.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086529

0 1
 O   -4.451900      -1.428000     -0.4557000    
 O    4.992100     -0.1155000      0.8215000    
 C   -1.770200      0.5958000      0.6796000    
 C   -2.328100     -0.8478000      0.5922000    
 C   -1.144600       1.146400     -0.6368000    
 C  -0.2562000      0.1213000      -1.386000    
 C   -1.516700      -1.797100     -0.2924000    
 C   -3.004700       1.428700       1.083500    
 C   -1.054000      -1.171200      -1.600200    
 C   -3.733300     -0.5830000      6.3900001E-02
 C   -4.159900      0.8498000      0.2708000    
 C   -2.485900      -1.484400       1.986000    
 C    1.128200      2.3000001E-03 -0.7564000    
 C  -0.3711000       2.414100     -0.3480000    
 C    1.704300       1.156600     -0.1787000    
 C   0.9522000       2.415100     -0.1413000    
 C    1.892400      -1.172100     -0.8111000    
 C    3.003400       1.111700      0.3439000    
 C    3.182500      -1.210500     -0.2778000    
 C    3.736600     -7.1999997E-02  0.2996000    
 C    5.684700      -1.360300      0.7434000    
 H   -1.018800      0.6505000       1.478800    
 H   -1.951200       1.418000      -1.331700    
 H  -6.3400000E-02  0.5268000      -2.391900    
 H   -2.105500      -2.693400     -0.5257000    
 H  -0.6381000      -2.149400      0.2620000    
 H   -2.890000       2.502200      0.9073000    
 H   -3.206100       1.306200       2.154600    
 H  -0.4770000      -1.902500      -2.176700    
 H   -1.935400     -0.9449000      -2.214900    
 H   -4.253300       1.339400     -0.7021000    
 H   -5.102900      0.9021000      0.8195000    
 H   -2.901200      -2.496300       1.906900    
 H   -1.518600      -1.557100       2.495200    
 H   -3.164300     -0.9186000       2.633000    
 H  -0.9198000       3.349400     -0.2887000    
 H    1.477900       3.336100      8.5400000E-02
 H    1.505400      -2.075000      -1.273100    
 H    3.448900       1.997900      0.7910000    
 H    3.700300      -2.160700     -0.3549000    
 H    5.864700      -1.656200     -0.2957000    
 H    5.173700      -2.142200       1.315400    
 H    6.665400      -1.214000       1.208100    


%chk=000086529-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086529

0 1
O -4.504427 -1.398851 -0.570335
O 5.035074 -0.069051 0.836045
C -1.742773 0.590717 0.679112
C -2.343323 -0.847062 0.544180
C -1.172844 1.154588 -0.671616
C -0.279553 0.134876 -1.437683
C -1.551168 -1.818050 -0.361293
C -2.959434 1.450378 1.158985
C -1.073982 -1.170094 -1.676933
C -3.778257 -0.572738 0.034266
C -4.179972 0.866817 0.399773
C -2.509623 -1.501455 1.954225
C 1.091317 -0.027620 -0.768117
C -0.399603 2.438685 -0.409271
C 1.704324 1.144703 -0.211178
C 0.946247 2.408057 -0.182934
C 1.831927 -1.225019 -0.772949
C 3.018020 1.083626 0.304395
C 3.145887 -1.299095 -0.246159
C 3.739815 -0.132893 0.291822
C 5.826748 -1.300452 0.833634
H -0.925624 0.596027 1.423959
H -2.035675 1.379163 -1.333762
H -0.079906 0.594512 -2.432628
H -2.200434 -2.686413 -0.584884
H -0.679395 -2.194270 0.208015
H -2.811333 2.525113 0.958233
H -3.098051 1.344557 2.249910
H -0.474162 -1.896308 -2.258099
H -1.954020 -0.930953 -2.306843
H -4.390626 1.411822 -0.540893
H -5.122586 0.870444 0.975774
H -2.969844 -2.501079 1.855024
H -1.515840 -1.617347 2.424430
H -3.141627 -0.901561 2.633218
H -0.947297 3.387238 -0.348069
H 1.492137 3.328146 0.062195
H 1.395080 -2.133055 -1.201991
H 3.497182 1.972930 0.727922
H 3.681841 -2.252573 -0.267671
H 5.999976 -1.666939 -0.197200
H 5.339441 -2.095135 1.431990
H 6.786866 -1.026189 1.295200


