%chk=000091424.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091424

0 1
 O   -7.357400      -1.711800      0.7071000    
 O   -6.283100      -1.355200      -1.257600    
 C   0.1094000      0.7104000     -0.1193000    
 C    1.356400     -5.8600001E-02  0.3262000    
 C   -1.200400      5.9400000E-02  0.3326000    
 C    2.662500      0.5528000     -0.1866000    
 C   -2.410400      0.8481000     -0.1747000    
 C    3.869300     -0.2937000      0.2250000    
 C   -3.749300      0.2370000      0.2429000    
 C    5.179300      0.3328000     -0.2589000    
 C   -5.014200       1.005900     -0.1685000    
 C    6.386200     -0.4978000      0.1827000    
 C   -6.321200      0.4252000      0.4026000    
 C    7.727700      9.6799999E-02 -0.2555000    
 C    8.936500     -0.6926000      0.2483000    
 C   -7.510300       1.321400      5.6400001E-02
 C   -6.623000     -0.9577000     -0.1506000    
 C    10.24200     -2.2299999E-02 -0.1520000    
 H   0.1613000       1.734400      0.2711000    
 H   0.1121000      0.7886000      -1.213800    
 H    1.379900     -0.1025000       1.422000    
 H    1.280600      -1.093600     -3.0300001E-02
 H   -1.225600      5.7999999E-03   1.427500    
 H   -1.249400     -0.9691000     -4.4199999E-02
 H    2.768300       1.570000      0.2090000    
 H    2.626900      0.6322000      -1.279900    
 H   -2.355300       1.876500      0.2033000    
 H   -2.375300      0.9107000      -1.269200    
 H    3.769700      -1.304500     -0.1890000    
 H    3.891400     -0.3921000       1.317200    
 H   -3.752100      0.1352000       1.336000    
 H   -3.803300     -0.7824000     -0.1582000    
 H    5.169500      0.4133000      -1.352500    
 H    5.270700       1.350100      0.1403000    
 H   -4.911100       2.043500      0.1739000    
 H   -5.062800       1.042300      -1.264300    
 H    6.296400      -1.514200     -0.2205000    
 H    6.377700     -0.5895000       1.276000    
 H   -6.222900      0.3480000       1.492300    
 H    7.757500      0.1494000      -1.351000    
 H    7.794600       1.128600      0.1119000    
 H    8.909600      -1.710400     -0.1572000    
 H    8.896500     -0.7765000       1.340400    
 H   -7.642800       1.406600      -1.028000    
 H   -7.370000       2.328100      0.4634000    
 H   -8.440500      0.9177000      0.4711000    
 H    10.31150      0.9855000      0.2696000    
 H    11.09380     -0.6033000      0.2149000    
 H    10.32590      5.3599998E-02  -1.240900    
 H   -7.562200      -2.595300      0.3335000    


%chk=000091424-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091424

0 1
O -7.441970 -1.745989 0.596359
O -6.303583 -1.336684 -1.382034
C 0.083045 0.683474 -0.139367
C 1.328842 -0.101860 0.329037
C -1.247785 0.068314 0.348465
C 2.660331 0.509856 -0.161507
C -2.493714 0.850207 -0.124708
C 3.905217 -0.280308 0.301150
C -3.823045 0.228885 0.359069
C 5.236964 0.327193 -0.193945
C -5.061951 1.016493 -0.122576
C 6.480919 -0.468255 0.262589
C -6.407479 0.430472 0.366515
C 7.813116 0.134443 -0.237308
C 9.055977 -0.665946 0.214989
C -7.606443 1.359335 0.015034
C -6.667089 -0.936397 -0.253730
C 10.382463 -0.059357 -0.291465
H 0.155693 1.732286 0.217990
H 0.077696 0.733468 -1.248409
H 1.335259 -0.151573 1.438211
H 1.254711 -1.150692 -0.027669
H -1.243980 0.019556 1.457710
H -1.318610 -0.980599 -0.008053
H 2.737158 1.557636 0.197895
H 2.651801 0.562558 -1.270493
H -2.425100 1.899631 0.232110
H -2.497132 0.897649 -1.233493
H 3.826062 -1.328609 -0.056204
H 3.915751 -0.331225 1.410243
H -3.822597 0.179317 1.468319
H -3.887489 -0.815646 -0.006928
H 5.224223 0.381629 -1.302826
H 5.319188 1.374158 0.166594
H -4.993238 2.064454 0.232886
H -5.069894 1.048618 -1.229676
H 6.396232 -1.515954 -0.095407
H 6.495917 -0.520238 1.371623
H -6.384320 0.293895 1.464266
H 7.798143 0.189233 -1.346181
H 7.902001 1.180911 0.123247
H 8.965038 -1.711712 -0.143842
H 9.071292 -0.718649 1.322955
H -7.670077 1.516356 -1.076826
H -7.466962 2.342898 0.497660
H -8.562441 0.933131 0.365904
H 10.513378 0.974243 0.081393
H 11.254189 -0.651771 0.042789
H 10.403643 -0.020753 -1.397102
H -7.628746 -2.611285 0.139246


%chk=000091424-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091424

0 1
O -7.441970 -1.745989 0.596359
O -6.303583 -1.336684 -1.382034
C 0.083045 0.683474 -0.139367
C 1.328842 -0.101860 0.329037
C -1.247785 0.068314 0.348465
C 2.660331 0.509856 -0.161507
C -2.493714 0.850207 -0.124708
C 3.905217 -0.280308 0.301150
C -3.823045 0.228885 0.359069
C 5.236964 0.327193 -0.193945
C -5.061951 1.016493 -0.122576
C 6.480919 -0.468255 0.262589
C -6.407479 0.430472 0.366515
C 7.813116 0.134443 -0.237308
C 9.055977 -0.665946 0.214989
C -7.606443 1.359335 0.015034
C -6.667089 -0.936397 -0.253730
C 10.382463 -0.059357 -0.291465
H 0.155693 1.732286 0.217990
H 0.077696 0.733468 -1.248409
H 1.335259 -0.151573 1.438211
H 1.254711 -1.150692 -0.027669
H -1.243980 0.019556 1.457710
H -1.318610 -0.980599 -0.008053
H 2.737158 1.557636 0.197895
H 2.651801 0.562558 -1.270493
H -2.425100 1.899631 0.232110
H -2.497132 0.897649 -1.233493
H 3.826062 -1.328609 -0.056204
H 3.915751 -0.331225 1.410243
H -3.822597 0.179317 1.468319
H -3.887489 -0.815646 -0.006928
H 5.224223 0.381629 -1.302826
H 5.319188 1.374158 0.166594
H -4.993238 2.064454 0.232886
H -5.069894 1.048618 -1.229676
H 6.396232 -1.515954 -0.095407
H 6.495917 -0.520238 1.371623
H -6.384320 0.293895 1.464266
H 7.798143 0.189233 -1.346181
H 7.902001 1.180911 0.123247
H 8.965038 -1.711712 -0.143842
H 9.071292 -0.718649 1.322955
H -7.670077 1.516356 -1.076826
H -7.466962 2.342898 0.497660
H -8.562441 0.933131 0.365904
H 10.513378 0.974243 0.081393
H 11.254189 -0.651771 0.042789
H 10.403643 -0.020753 -1.397102
H -7.628746 -2.611285 0.139246


