%chk=000108659.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108659

0 1
 O   -1.212100       2.689500      3.0000001E-04
 O   -5.616800      -1.775600       0.000000    
 C    4.264700     -0.7178000      9.9999997E-05
 C    2.842400     -0.1334000     -6.0000003E-04
 C    4.469000      -1.588600      -1.258400    
 C    4.468200      -1.588700       1.258700    
 C    5.380000      0.3522000      5.0000002E-04
 C    1.780800      -1.003400      9.9999997E-05
 C    2.698800       1.231500     -6.9999998E-04
 C   0.3044000      0.9087000      9.9999997E-05
 C   0.4905000     -0.4735000      3.0000001E-04
 C    1.408400       1.761300     -3.9999999E-04
 C   -1.040900       1.461300      9.9999997E-05
 C   -2.261100      0.5990000      1.9999999E-04
 C   -2.798200      0.2194000       1.208000    
 C   -2.797800      0.2191000      -1.208000    
 C   -3.936900     -0.5860000       1.207900    
 C   -3.936800     -0.5862000      -1.208100    
 C   -4.506500     -0.9888000     -9.9999997E-05
 H    5.491100      -1.982800      -1.303600    
 H    3.794700      -2.451600      -1.283800    
 H    4.295600      -1.008200      -2.172400    
 H    3.794200      -2.451800       1.283600    
 H    5.490400      -1.982500       1.304700    
 H    4.294000      -1.008300       2.172600    
 H    6.370800     -0.1193000      1.1000000E-03
 H    5.338300      0.9893000     -0.8908000    
 H    5.337400      0.9894000      0.8917000    
 H    1.901900      -2.081200      3.9999999E-04
 H    3.518500       1.938300     -1.0000000E-03
 H  -0.3399000      -1.172900      6.0000003E-04
 H    1.289600       2.841700     -6.0000003E-04
 H   -2.358000      0.5309000       2.150300    
 H   -2.357400      0.5304000      -2.150200    
 H   -4.370700     -0.8930000       2.155800    
 H   -4.375500     -0.8970000      -2.152500    
 H   -5.874000      -1.957600      0.9202000    


%chk=000108659-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108659

0 1
O -1.193887 2.356290 1.438813
O -5.852701 -1.502268 -0.739711
C 4.427136 -0.705540 -0.199686
C 2.993729 -0.182708 0.051484
C 4.436069 -1.584138 -1.487933
C 4.877241 -1.571425 1.016704
C 5.451336 0.443434 -0.385689
C 1.926301 -1.105508 0.235404
C 2.678967 1.201040 0.122401
C 0.300837 0.714740 0.519015
C 0.605289 -0.672703 0.458237
C 1.362862 1.641529 0.362778
C -1.070619 1.244393 0.827441
C -2.293880 0.477348 0.423718
C -3.498750 0.714866 1.139626
C -2.327514 -0.411688 -0.687951
C -4.693615 0.066365 0.784836
C -3.520326 -1.054097 -1.065502
C -4.701256 -0.822426 -0.321690
H 5.454445 -1.973190 -1.674871
H 3.754248 -2.448456 -1.397328
H 4.122690 -0.995245 -2.369256
H 4.204590 -2.432909 1.175191
H 5.897580 -1.963488 0.847254
H 4.885383 -0.972023 1.945224
H 6.455276 0.017801 -0.566471
H 5.198308 1.082601 -1.251745
H 5.517089 1.083670 0.513250
H 2.129023 -2.182378 0.210768
H 3.467666 1.947867 -0.005660
H -0.185121 -1.412514 0.623044
H 1.133447 2.709716 0.439988
H -3.471808 1.423277 1.973841
H -1.423501 -0.573929 -1.283154
H -5.612904 0.249090 1.356356
H -3.561686 -1.725358 -1.927966
H -6.630844 -1.268235 -0.174661


