%chk=000068167.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068167

0 1
 O    4.692200      0.1180000     -0.8798000    
 O    3.692700     -0.2900000       1.123600    
 C   -1.570500       2.653200      1.9500000E-02
 C  -0.1642000       2.643900     -0.5844000    
 C   -2.606800       2.138200     -0.9824000    
 C   0.2613000      -2.998700      0.2321000    
 C   -1.089300      -2.439100     -0.2258000    
 C    1.496800      -2.258900     -0.2907000    
 C   0.8673000       3.200500      0.3980000    
 C   -4.038800       2.154400     -0.4319000    
 C   -2.286000      -3.247500      0.2891000    
 C    2.846400      -2.851500      0.1231000    
 C    2.265800       3.222900     -0.2182000    
 C   -4.280600       1.231900      0.7648000    
 C   -3.623900      -2.728400     -0.2417000    
 C    4.040900      -2.103200     -0.4656000    
 C    3.299700       3.748100      0.7648000    
 C   -4.051800     -0.1789000      0.4255000    
 C   -3.863100      -1.328400      0.1333000    
 C    4.112100     -0.6866000      4.6599999E-02
 H   -1.569600       2.029400      0.9199000    
 H   -1.834800       3.671800      0.3282000    
 H  -0.1557000       3.244100      -1.502400    
 H   0.1090000       1.619200     -0.8650000    
 H   -2.579700       2.771700      -1.878000    
 H   -2.337600       1.127800      -1.311400    
 H   0.3290000      -4.048800     -7.9200000E-02
 H   0.2908000      -2.998800       1.329000    
 H   -1.111800      -2.421200      -1.322400    
 H   -1.160500      -1.398100      0.1104000    
 H    1.446700      -2.235900      -1.386900    
 H    1.430500      -1.215800      4.0500000E-02
 H   0.5824000       4.216700      0.6963000    
 H   0.8751000       2.586800       1.307100    
 H   -4.299800       3.180400     -0.1442000    
 H   -4.721700       1.876000      -1.245200    
 H   -2.173100      -4.297000     -8.3999997E-03
 H   -2.289400      -3.224900       1.386200    
 H    2.892600      -3.896500     -0.2064000    
 H    2.914200      -2.862700       1.217900    
 H    2.548600       2.212100     -0.5330000    
 H    2.267800       3.853800      -1.114600    
 H   -3.653000       1.523500       1.613100    
 H   -5.319200       1.354400       1.094800    
 H   -4.431900      -3.356100      0.1513000    
 H   -3.648600      -2.825700      -1.333400    
 H    3.958200      -2.092600      -1.558400    
 H    4.974400      -2.607100     -0.1943000    
 H    3.061400       4.769900       1.076700    
 H    4.291800       3.755900      0.3026000    
 H    3.346800       3.117200       1.658300    
 H    4.744500       1.048900     -0.5748000    


%chk=000068167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068167

0 1
O 4.832454 0.378042 -0.355235
O 3.371900 -0.024142 1.402319
C -1.548049 2.575514 0.054788
C -0.200911 2.652702 -0.700158
C -2.735209 2.224520 -0.871763
C 0.248592 -3.047755 0.180246
C -1.086475 -2.520466 -0.390307
C 1.467333 -2.218157 -0.281098
C 0.993654 3.020902 0.208497
C -4.117980 2.241089 -0.178832
C -2.312875 -3.323746 0.092609
C 2.795880 -2.702531 0.342151
C 2.329562 3.137942 -0.560448
C -4.290909 1.170834 0.940824
C -3.666375 -2.743359 -0.413345
C 4.019398 -1.880302 -0.114039
C 3.512762 3.524691 0.354649
C -4.098385 -0.214241 0.467700
C -3.919101 -1.366057 0.056336
C 4.004606 -0.455447 0.411580
H -1.462123 1.821226 0.863085
H -1.743989 3.549426 0.551906
H -0.284889 3.400333 -1.517293
H -0.001843 1.676651 -1.191487
H -2.755527 2.945941 -1.714803
H -2.568987 1.223371 -1.318282
H 0.388239 -4.109398 -0.114539
H 0.199814 -3.034596 1.289000
H -1.048671 -2.536552 -1.500010
H -1.216760 -1.459702 -0.095946
H 1.541131 -2.256001 -1.388394
H 1.303833 -1.156753 -0.006787
H 0.781210 3.983385 0.720143
H 1.102841 2.257753 1.006409
H -4.296257 3.239194 0.271162
H -4.907687 2.082787 -0.938846
H -2.232591 -4.375294 -0.250837
H -2.325396 -3.345921 1.200145
H 2.965804 -3.764162 0.074108
H 2.719166 -2.653989 1.445306
H 2.541326 2.172128 -1.063481
H 2.224066 3.890683 -1.368214
H -3.575422 1.375892 1.761909
H -5.302686 1.272994 1.381821
H -4.494211 -3.403159 -0.084751
H -3.675736 -2.759464 -1.522662
H 4.100520 -1.843717 -1.215665
H 4.958444 -2.346047 0.248489
H 3.349577 4.516471 0.816489
H 4.466192 3.585060 -0.208620
H 3.620566 2.796097 1.182398
H 4.807775 1.303630 0.015972


