%chk=000068930.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068930

0 1
 O  -0.2659000      -2.602800     -0.7471000    
 O   -4.792400      0.1240000       2.565000    
 O    4.565800      -1.719400      0.3092000    
 C  -8.2999997E-02  0.9607000     -0.6319000    
 C    1.221400       1.046300      0.1741000    
 C  -0.8809000     -0.2982000     -0.1658000    
 C    2.129400     -0.1904000     -1.6000001E-02
 C   -2.264700     -0.4339000     -0.8955000    
 C   -3.072300      0.9014000     -0.7222000    
 C  -0.9114000       2.242100     -0.4800000    
 C    3.332500      0.2506000      0.8450000    
 C    2.164400       2.219800     -7.3600002E-02
 C    1.379400      -1.416100      0.5080000    
 C   -2.268600       2.134400      -1.166400    
 C   4.2900000E-02  -1.538300     -0.2157000    
 C   -3.132300      -1.599300     -0.3306000    
 C    3.505000       1.747900      0.5158000    
 C   -3.596300       1.104000      0.7157000    
 C   -2.073900     -0.7111000      -2.409800    
 C    2.553900     -0.4390000      -1.487900    
 C   -3.621300      -1.383000       1.096200    
 C   -4.410600     -8.6300001E-02   1.209600    
 C    4.591000     -0.5291000      0.6186000    
 C    5.887800      0.2157000      0.7854000    
 H   0.1672000      0.8650000      -1.693400    
 H   0.9333000       1.105500       1.237300    
 H   -1.086200     -0.1728000      0.9062000    
 H   -3.959900      0.8487000      -1.369600    
 H  -0.3690000       3.090400     -0.9145000    
 H   -1.048300       2.478600      0.5818000    
 H    3.090700      0.1549000       1.912500    
 H    1.817200       3.136600      0.4137000    
 H    2.267800       2.431500      -1.143800    
 H    1.171100      -1.340300       1.581500    
 H    1.954600      -2.334900      0.3507000    
 H   -2.844800       3.047200     -0.9707000    
 H   -2.119200       2.104800      -2.252300    
 H   -2.603800      -2.555400     -0.3802000    
 H   -4.016900      -1.725000     -0.9710000    
 H    4.291900       1.960300     -0.2140000    
 H    3.741900       2.311400       1.425700    
 H   -2.777800       1.292400       1.420200    
 H   -4.221200       2.005800      0.7583000    
 H   -1.444000      3.2699998E-02  -2.903600    
 H   -1.623500      -1.691100      -2.592100    
 H   -3.039500     -0.7067000      -2.929600    
 H    3.167900      0.3736000      -1.888900    
 H    3.128400      -1.364300      -1.595500    
 H    1.693700     -0.5499000      -2.154700    
 H   -4.257100      -2.223100       1.401900    
 H   -2.783000      -1.383500       1.802800    
 H   -5.332000     -0.1715000      0.6207000    
 H    6.127200      0.7761000     -0.1207000    
 H    5.845200      0.8757000       1.655400    
 H    6.689100     -0.5085000      0.9639000    
 H   -5.300500      0.9522000       2.601800    


%chk=000068930-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000068930

0 1
O -0.272613 -2.583755 -0.887068
O -4.697256 0.006048 2.735543
O 4.629763 -1.748127 0.237732
C -0.101689 1.010508 -0.716033
C 1.229257 1.102732 0.055592
C -0.890778 -0.271038 -0.234955
C 2.138815 -0.155506 -0.118857
C -2.295152 -0.423747 -0.921292
C -3.118854 0.901281 -0.695435
C -0.962510 2.283397 -0.527109
C 3.375742 0.304441 0.712241
C 2.183213 2.294222 -0.224507
C 1.374898 -1.387631 0.436529
C -2.352846 2.155766 -1.186943
C 0.027193 -1.515266 -0.287603
C -3.120065 -1.611189 -0.320540
C 3.587462 1.802956 0.275831
C -3.582807 1.080961 0.778660
C -2.148524 -0.692291 -2.445717
C 2.526418 -0.417411 -1.600050
C -3.561051 -1.419817 1.147354
C -4.375995 -0.132025 1.299410
C 4.632192 -0.570171 0.688539
C 5.898916 0.034247 1.288055
H 0.118039 0.906462 -1.797845
H 0.963697 1.146673 1.138651
H -1.057406 -0.104160 0.854280
H -4.038130 0.797671 -1.314001
H -0.425662 3.152008 -0.955807
H -1.072954 2.488144 0.558090
H 3.064814 0.319207 1.783551
H 1.861268 3.214507 0.293059
H 2.212461 2.522797 -1.306327
H 1.188723 -1.245987 1.522423
H 1.946343 -2.319441 0.295058
H -2.953182 3.063022 -0.973730
H -2.231931 2.111845 -2.286828
H -2.546959 -2.546488 -0.430337
H -4.029756 -1.724577 -0.948362
H 4.334104 1.869038 -0.536601
H 3.965533 2.416716 1.112317
H -2.723429 1.235216 1.459178
H -4.206520 1.998167 0.843176
H -1.532191 0.065020 -2.961229
H -1.687644 -1.679260 -2.615098
H -3.145916 -0.689171 -2.926149
H 3.031392 0.451995 -2.058093
H 3.208178 -1.281557 -1.656260
H 1.641257 -0.654084 -2.216515
H -4.169279 -2.282282 1.476866
H -2.691062 -1.367766 1.830693
H -5.319127 -0.224513 0.711955
H 6.301153 0.814476 0.613614
H 5.689084 0.524740 2.256618
H 6.661429 -0.749311 1.419146
H -5.219656 0.838707 2.865027


