%chk=000061406.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061406

0 1
 O   -4.743200      0.1421000      0.3048000    
 O   -3.535900      -1.513700     -0.7539000    
 C    3.955600      0.2861000     -0.2117000    
 C    4.369800     -0.9365000      0.6181000    
 C    5.055200       1.356500     -0.1942000    
 C    2.635000      0.8611000      0.2972000    
 C    5.714900      -1.497600      0.1625000    
 C    6.399000      0.7914000     -0.6487000    
 C    6.803300     -0.4289000      0.1727000    
 C    1.442100      3.6800001E-02 -0.1862000    
 C   0.1196000      0.6348000      0.2980000    
 C   -1.073000     -0.2085000     -0.1633000    
 C   -2.408000      0.3495000      0.3296000    
 C   -3.597500     -0.4758000     -0.1094000    
 C   -5.963100     -0.5089000     -6.4900003E-02
 C   -7.110600      0.2881000      0.4602000    
 C   -8.063400      0.8236000     -0.3108000    
 H    3.827500     -3.1399999E-02  -1.255900    
 H    3.618100      -1.729500      0.5413000    
 H    4.437100     -0.6640000       1.679200    
 H    5.159400       1.766900      0.8184000    
 H    4.777900       2.191300     -0.8490000    
 H    2.636000      0.9263000       1.392200    
 H    2.512900       1.885800     -7.7100001E-02
 H    6.008000      -2.327700      0.8153000    
 H    5.615000      -1.907500     -0.8500000    
 H    6.338800      0.5146000      -1.708500    
 H    7.171000       1.564600     -0.5643000    
 H    7.004000     -0.1224000       1.206700    
 H    7.735500     -0.8477000     -0.2230000    
 H    1.440700     -6.8999999E-03  -1.282200    
 H    1.521100     -0.9934000      0.1779000    
 H   0.1221000      0.6946000       1.393100    
 H   1.4300000E-02   1.657900     -8.2599998E-02
 H   -1.082500     -0.2625000      -1.259300    
 H  -0.9551000      -1.238000      0.1978000    
 H   -2.539300       1.366600     -5.7100002E-02
 H   -2.409000      0.3850000       1.425000    
 H   -5.989300      -1.509900      0.3807000    
 H   -6.008300     -0.6027000      -1.156400    
 H   -7.168200      0.4325000       1.535900    
 H   -8.873900       1.391600      0.1327000    
 H   -8.053500      0.7074000      -1.388900    


%chk=000061406-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061406

0 1
O -4.798351 0.302182 0.104357
O -3.696912 -1.720771 0.469162
C 4.009008 0.326515 -0.249372
C 4.447565 -1.044287 0.332289
C 5.129631 1.377626 -0.030905
C 2.667113 0.827304 0.342730
C 5.807907 -1.512653 -0.239073
C 6.489443 0.916406 -0.605169
C 6.911101 -0.451093 -0.016864
C 1.431800 -0.030525 -0.015358
C 0.108441 0.592894 0.482800
C -1.131414 -0.258590 0.134611
C -2.445750 0.414543 0.589020
C -3.663567 -0.471155 0.387087
C -6.083971 -0.456213 -0.060931
C -7.205179 0.535820 0.063922
C -8.191819 0.683286 -0.854137
H 3.874547 0.200580 -1.348019
H 3.675145 -1.811874 0.132131
H 4.527526 -0.950620 1.437004
H 5.237773 1.562759 1.059482
H 4.830410 2.341963 -0.488866
H 2.761259 0.892686 1.448034
H 2.490278 1.864406 -0.014408
H 6.102171 -2.475065 0.223659
H 5.699858 -1.700948 -1.327793
H 6.408416 0.827159 -1.708770
H 7.267736 1.678068 -0.402232
H 7.093063 -0.337951 1.072450
H 7.864843 -0.787193 -0.468722
H 1.383442 -0.158518 -1.117272
H 1.535817 -1.047442 0.413194
H 0.161688 0.733206 1.583208
H -0.002341 1.607612 0.045408
H -1.166779 -0.432426 -0.959276
H -1.055017 -1.256243 0.606691
H -2.611941 1.376650 0.073623
H -2.383974 0.644583 1.673244
H -6.118455 -1.235606 0.724516
H -6.073346 -0.955753 -1.045795
H -7.204819 1.140663 0.980943
H -9.013552 1.391322 -0.702533
H -8.208693 0.098293 -1.782169


