%chk=000173847.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173847

0 1
 O   0.5523000       3.897300     -0.3251000    
 O   -6.012200     -0.4049000      9.1100000E-02
 O    5.964500     -4.1700002E-02  0.1864000    
 C  -0.4535000      0.3003000      0.2342000    
 C   0.4043000     -0.7358000      5.0099999E-02
 C  -1.4100000E-02   1.719900      0.5560000    
 C  -2.9100001E-02  -2.174500     -0.1591000    
 C   -1.923800      0.1133000      0.1970000    
 C    1.874900     -0.5520000      8.6900003E-02
 C   0.1124000       2.595800     -0.6888000    
 C  -0.2341000      -2.508600      -1.631300    
 C   -2.591200     -0.1848000       1.368400    
 C   -2.583700      0.2431000      -1.009300    
 C    2.536700     -0.6826000       1.291800    
 C    2.541000     -0.2558000      -1.086100    
 C   -3.974500     -0.3603000       1.332300    
 C   -3.967000      6.7699999E-02  -1.045500    
 C    3.920400     -0.5097000       1.325400    
 C    3.924800     -8.2900003E-02  -1.052800    
 C   -4.662600     -0.2339000      0.1255000    
 C    4.614500     -0.2100000      0.1530000    
 H   0.9366000       1.733900       1.101900    
 H  -0.7197000       2.185900       1.257400    
 H  -0.9548000      -2.388100      0.3869000    
 H   0.7128000      -2.863000      0.2653000    
 H  -0.8443000       2.697300      -1.210700    
 H   0.8390000       2.184400      -1.395000    
 H   0.6998000      -2.416600      -2.194900    
 H  -0.5795000      -3.542700      -1.733000    
 H  -0.9788000      -1.861900      -2.102000    
 H   -2.065300     -0.2853000       2.313800    
 H   -2.053500      0.4787000      -1.927800    
 H    2.005900     -0.9159000       2.210700    
 H    2.014700     -0.1526000      -2.031000    
 H   -4.510700     -0.5952000       2.247800    
 H   -4.491200      0.1689000      -1.992000    
 H    4.452100     -0.6099000       2.267700    
 H    4.453600      0.1509000      -1.972800    
 H  -0.1051000       4.267800      0.2881000    
 H   -6.322200     -0.2816000     -0.8226000    
 H    6.279100      0.1599000     -0.7117000    


%chk=000173847-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173847

0 1
O 0.198038 4.101327 -0.184884
O -6.201243 -0.100141 0.040683
O 6.142601 -0.292647 0.008513
C -0.457198 0.312929 0.252251
C 0.399784 -0.752422 0.064197
C 0.030558 1.723037 0.586260
C -0.089495 -2.192116 -0.100504
C -1.950933 0.170587 0.182005
C 1.892635 -0.594553 0.046447
C -0.256620 2.746888 -0.539130
C 0.217547 -2.795974 -1.496090
C -2.779023 0.581969 1.265647
C -2.597790 -0.332274 -0.979485
C 2.721626 -1.379083 0.899151
C 2.538937 0.299433 -0.849378
C -4.181904 0.479904 1.207385
C -4.003022 -0.435238 -1.059072
C 4.124233 -1.263045 0.881083
C 3.943910 0.423505 -0.887778
C -4.796582 -0.029282 0.040192
C 4.737958 -0.358672 -0.016026
H 1.110196 1.731709 0.808605
H -0.492755 2.076023 1.501344
H -1.171480 -2.255420 0.104501
H 0.412549 -2.824117 0.660709
H -1.336514 2.746168 -0.795309
H 0.315510 2.497766 -1.448576
H 1.300229 -2.762812 -1.713011
H -0.110410 -3.850626 -1.545830
H -0.303309 -2.238294 -2.296430
H -2.316975 0.963130 2.183601
H -1.989613 -0.633237 -1.839387
H 2.260902 -2.076212 1.608216
H 1.932817 0.895226 -1.540002
H -4.812140 0.782402 2.048989
H -4.473430 -0.821802 -1.972884
H 4.755093 -1.856399 1.549555
H 4.412605 1.121719 -1.593692
H -0.297814 4.403475 0.617898
H -6.536078 -0.473299 -0.812265
H 6.475101 0.375267 -0.641301


