%chk=000082610.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082610

0 1
 O    2.191900     -0.9510000      7.5700000E-02
 O    3.152400      0.6772000      -1.247100    
 C   -1.937400     -4.8300002E-02  0.4323000    
 C   -3.380600      0.2993000      7.2099999E-02
 C   -1.530300      -1.389000     -0.1948000    
 C  -0.9848000       1.073300     -4.4999998E-03
 C  -7.4100003E-02  -1.731000      0.1064000    
 C   0.4698000      0.7244000      0.2957000    
 C   0.8694000     -0.6118000     -0.3267000    
 C   -3.779600       1.623400      0.7453000    
 C   -3.514600      0.4467000      -1.452900    
 C   -4.320500     -0.8174000      0.5567000    
 C    3.167500     -5.2299999E-02 -0.2653000    
 C    4.270500     -0.1023000      0.7659000    
 C    5.400600      0.8589000      0.4412000    
 H   -1.854000     -0.1511000       1.524100    
 H   -1.635100      -1.383900      -1.283400    
 H   -2.141100      -2.212000      0.1889000    
 H   -1.206400       2.010200      0.5159000    
 H   -1.047100       1.272600      -1.078100    
 H   4.9400002E-02  -1.924400       1.180200    
 H   0.2057000      -2.665600     -0.3952000    
 H    1.104600       1.541900     -6.2899999E-02
 H   0.6257000      0.6860000       1.382200    
 H   0.8411000     -0.5392000      -1.422100    
 H   -3.558100       1.608700       1.818200    
 H   -4.856100       1.803500      0.6380000    
 H   -3.281400       2.490700      0.3006000    
 H   -3.300100     -0.4713000      -2.005500    
 H   -2.916600       1.259500      -1.871900    
 H   -4.555500      0.6964000      -1.700000    
 H   -4.218300      -1.738500     -2.5800001E-02
 H   -5.369000     -0.5109000      0.4589000    
 H   -4.148600      -1.054100       1.612700    
 H    3.843700      0.1549000       1.741100    
 H    4.663400      -1.123700      0.8038000    
 H    5.038900       1.891800      0.4016000    
 H    6.182900      0.7992000       1.203900    
 H    5.849700      0.6242000     -0.5295000    


%chk=000082610-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082610

0 1
O 2.247213 -0.494965 0.589331
O 3.266476 0.873008 -1.007816
C -2.058863 0.024263 0.363425
C -3.571564 0.221068 -0.037633
C -1.408937 -1.260303 -0.225092
C -1.152364 1.243560 0.032480
C 0.037119 -1.467566 0.291228
C 0.293740 1.046386 0.552795
C 0.899365 -0.241702 -0.026682
C -4.142893 1.480385 0.674859
C -3.758753 0.386451 -1.570955
C -4.403616 -1.004333 0.438308
C 3.348076 0.135153 0.001974
C 4.618679 -0.210418 0.766358
C 5.889024 0.348167 0.101676
H -2.052759 -0.090272 1.472729
H -1.393104 -1.194278 -1.332097
H -2.005698 -2.153311 0.033524
H -1.562190 2.168677 0.476055
H -1.123231 1.399673 -1.065113
H 0.026934 -1.621262 1.388344
H 0.485510 -2.371081 -0.162535
H 0.922865 1.912763 0.278448
H 0.286874 0.968671 1.658311
H 1.047267 -0.126474 -1.118393
H -3.965013 1.436350 1.766818
H -5.235219 1.548392 0.512665
H -3.694725 2.414883 0.292787
H -3.410289 -0.504447 -2.124900
H -3.213674 1.266630 -1.958249
H -4.830037 0.527652 -1.808825
H -4.140415 -1.925371 -0.111966
H -5.482288 -0.819902 0.275786
H -4.251276 -1.194468 1.518452
H 4.504698 0.180538 1.796373
H 4.666165 -1.310798 0.870566
H 5.832044 1.445311 0.000671
H 6.780007 0.095954 0.703609
H 6.022752 -0.067983 -0.911615


