%chk=000127606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127606

0 1
 O  -5.2299999E-02   1.350500       1.437400    
 O   -5.939900     -0.6646000     -0.1405000    
 O    5.911900     -7.0900001E-02 -0.4281000    
 C  -0.4622000      4.7600001E-02   1.002900    
 C   0.3901000      0.9285000      0.1464000    
 C   0.1665000      -1.039400       1.806300    
 C  -0.2210000       1.713200     -0.9577000    
 C   -1.898500     -0.1399000      0.7032000    
 C    1.849000      0.6649000     -5.9000002E-03
 C   0.3620000      -2.312400      0.9959000    
 C   0.2967000       3.145100      -1.005200    
 C   -2.871300      0.2208000       1.643900    
 C    2.758700       1.247600      0.8766000    
 C   -2.301600     -0.6791000     -0.5247000    
 C    2.304600     -0.1650000      -1.030100    
 C   -4.225900      4.5000002E-02   1.361000    
 C    4.124100       1.000200      0.7347000    
 C   -3.656300     -0.8548000     -0.8075000    
 C    3.670100     -0.4125000      -1.171900    
 C   -4.618300     -0.4928000      0.1354000    
 C    4.579800      0.1702000     -0.2894000    
 C   -6.335100     -0.5725000      -1.508400    
 C    6.290000      -1.332200     -0.9781000    
 C   -7.760900     -6.8599999E-02  -1.576900    
 C    7.639800      -1.729000     -0.4194000    
 H  -0.4552000      -1.269100       2.681500    
 H    1.134800     -0.7344000       2.220200    
 H   -1.307500       1.801100     -0.8561000    
 H  -4.7499999E-02   1.230400      -1.926700    
 H  -0.5999000      -2.763500      0.7312000    
 H   0.9139000      -2.150600      7.0200004E-02
 H   0.9121000      -3.049600       1.590100    
 H   0.1245000       3.662500     -5.5700000E-02
 H    1.369600       3.179900      -1.219300    
 H  -0.2166000       3.705000      -1.793700    
 H   -2.580700      0.6400000       2.604000    
 H    2.427600       1.902700       1.677800    
 H   -1.564100     -0.9790000      -1.265300    
 H    1.608200     -0.6199000      -1.729800    
 H   -4.970800      0.3286000       2.099500    
 H    4.828300       1.457900       1.424000    
 H   -3.917700      -1.303600      -1.761200    
 H    3.984700      -1.041800      -1.999000    
 H   -5.709400      0.1345000      -2.067500    
 H   -6.270100      -1.564300      -1.969300    
 H    5.578300      -2.123700     -0.7113000    
 H    6.351000      -1.245600      -2.068500    
 H   -7.844700      0.9171000      -1.107300    
 H   -8.433300     -0.7388000      -1.031200    
 H   -8.101200      4.4000000E-03  -2.613700    
 H    7.598100      -1.806200      0.6721000    
 H    8.393000     -0.9700000     -0.6557000    
 H    7.966500      -2.689000     -0.8290000    


%chk=000127606-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127606

0 1
O -0.033728 1.347718 1.504407
O -6.165083 0.058447 -0.252209
O 6.073645 -0.450973 0.113295
C -0.534153 0.028610 0.931562
C 0.469983 0.876991 0.150497
C -0.057417 -1.187283 1.734710
C -0.005684 1.755263 -1.009452
C -1.996708 0.038909 0.557927
C 1.932285 0.496239 0.125912
C -0.064301 -2.514335 0.941798
C 0.700596 3.129279 -1.031397
C -2.923703 0.751925 1.363505
C 2.796221 0.850487 1.195269
C -2.487436 -0.682186 -0.555963
C 2.482409 -0.192427 -0.981609
C -4.298602 0.737369 1.070562
C 4.163564 0.523748 1.161044
C -3.866514 -0.705413 -0.867200
C 3.853060 -0.533214 -1.030891
C -4.777171 0.005603 -0.045926
C 4.699160 -0.171518 0.047950
C -6.718134 -0.677419 -1.405254
C 6.685663 -1.169705 -1.020697
C -8.228266 -0.456168 -1.387247
C 8.167685 -1.331121 -0.692610
H -0.708470 -1.282229 2.625784
H 0.964175 -0.980784 2.098994
H -1.097097 1.896381 -0.925986
H 0.178541 1.221223 -1.963850
H -1.080846 -2.781285 0.603471
H 0.595567 -2.451067 0.056935
H 0.306151 -3.337846 1.578539
H 0.517648 3.667492 -0.084321
H 1.792562 3.022363 -1.159725
H 0.316535 3.750932 -1.860387
H -2.548068 1.335657 2.210154
H 2.373656 1.385066 2.051905
H -1.788300 -1.224747 -1.203110
H 1.839028 -0.474095 -1.824147
H -5.019071 1.286937 1.684209
H 4.835531 0.796919 1.980512
H -4.210740 -1.267756 -1.740241
H 4.242054 -1.070521 -1.900842
H -6.265645 -0.290587 -2.342053
H -6.467742 -1.754642 -1.311343
H 6.191309 -2.155772 -1.144100
H 6.540992 -0.583375 -1.951955
H -8.464640 0.618359 -1.469788
H -8.665722 -0.836048 -0.448313
H -8.700707 -0.985880 -2.234504
H 8.298770 -1.905857 0.239993
H 8.646623 -0.345751 -0.562773
H 8.682434 -1.867014 -1.510843


