%chk=000066845.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066845

0 1
 O    3.593600      0.4427000      0.1022000    
 O    5.112300     -0.9085000     -0.9891000    
 O   -7.359800      0.8055000      0.4843000    
 C    1.143600      0.1648000      6.5300003E-02
 C   0.3023000      -1.068100     -0.3218000    
 C   -1.156400     -0.9310000      0.1136000    
 C   -1.778900      0.3020000     -0.6093000    
 C    2.521800     -0.3071000     -0.4360000    
 C   0.5720000       1.382700     -0.6707000    
 C    1.130600      -2.240300      0.1967000    
 C  -0.9275000       1.579100     -0.3756000    
 C    2.587500      -1.786500     -8.2000000E-03
 C   -1.987300      -2.172400     -0.2161000    
 C    1.196900      0.4642000       1.585400    
 C   -3.262700      0.4446000     -0.2813000    
 C   -3.388500      -2.028000      0.3701000    
 C   -4.015000     -0.6745000      0.1386000    
 C   -3.936300       1.663800     -0.4729000    
 C   -5.388700     -0.5355000      0.4043000    
 C    4.855900      3.5700001E-02 -0.2548000    
 C   -5.303300       1.785800     -0.2142000    
 C   -6.029000      0.6877000      0.2291000    
 C    5.880100      0.9340000      0.4005000    
 C    7.308400      0.5151000      6.1299998E-02
 C    8.328300       1.444400      0.6988000    
 H   0.2999000      -1.160700      -1.420900    
 H   -1.202400     -0.7828000       1.200200    
 H   -1.745700      0.1038000      -1.692000    
 H    2.559400     -0.2388000      -1.532400    
 H   0.6964000       1.257200      -1.754300    
 H    1.122800       2.292000     -0.4019000    
 H   0.9209000      -3.164800     -0.3511000    
 H   0.9352000      -2.432100       1.257700    
 H   -1.063300       1.931900      0.6539000    
 H   -1.277000       2.391000      -1.023900    
 H    3.166500      -1.935200      0.9103000    
 H    3.057300      -2.393400     -0.7902000    
 H   -1.526000      -3.079200      0.1906000    
 H   -2.049000      -2.306000      -1.303900    
 H    1.814300       1.348500       1.782200    
 H   0.2111000      0.6675000       2.011800    
 H    1.628100     -0.3619000       2.159700    
 H   -3.340900      -2.195000       1.453900    
 H   -4.028000      -2.811000     -5.5199999E-02
 H   -3.413700       2.543900     -0.8352000    
 H   -5.962300      -1.393500      0.7490000    
 H   -5.787800       2.746400     -0.3683000    
 H    5.702000       1.958800      5.6000002E-02
 H    5.729600      0.8902000       1.484900    
 H    7.487900     -0.5113000      0.4033000    
 H    7.450700      0.5153000      -1.026100    
 H   -7.635000       1.721600      0.3080000    
 H    9.343600       1.125000      0.4438000    
 H    8.196800       2.472400      0.3462000    
 H    8.234500       1.440300       1.789500    


%chk=000066845-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066845

0 1
O 3.662779 0.204442 0.334521
O 5.089554 -0.577541 -1.340278
O -7.418306 1.021486 0.232125
C 1.169409 -0.016051 0.211312
C 0.271382 -1.225463 -0.212397
C -1.207033 -1.018507 0.156975
C -1.725537 0.262212 -0.571020
C 2.535865 -0.571787 -0.260969
C 0.669469 1.247480 -0.527462
C 1.038156 -2.470136 0.312178
C -0.839392 1.504286 -0.259594
C 2.548476 -2.068877 0.175391
C -2.108773 -2.213810 -0.217579
C 1.196918 0.224702 1.744209
C -3.226792 0.484372 -0.318979
C -3.532192 -1.999259 0.333593
C -4.077850 -0.596341 0.070292
C -3.821540 1.755896 -0.520737
C -5.463752 -0.377387 0.243179
C 4.900448 0.112709 -0.311803
C -5.203491 1.978370 -0.348037
C -6.027847 0.897006 0.038407
C 5.937831 0.957397 0.412285
C 7.329736 0.910513 -0.248811
C 8.359671 1.766404 0.517274
H 0.314728 -1.267833 -1.326683
H -1.292162 -0.866747 1.254854
H -1.601779 0.056238 -1.661213
H 2.630567 -0.491382 -1.361201
H 0.822962 1.112862 -1.619410
H 1.257247 2.136180 -0.225435
H 0.799434 -3.378639 -0.267851
H 0.775015 -2.678320 1.366496
H -0.999001 1.812859 0.791991
H -1.155961 2.359930 -0.885373
H 3.080549 -2.164641 1.139182
H 3.088140 -2.686618 -0.561096
H -1.693628 -3.156311 0.187304
H -2.135756 -2.317835 -1.322021
H 1.918682 1.026011 1.978322
H 0.209963 0.529329 2.130222
H 1.511611 -0.674975 2.301507
H -3.520389 -2.171275 1.430474
H -4.228632 -2.750761 -0.085468
H -3.198849 2.603305 -0.824438
H -6.123923 -1.200463 0.538472
H -5.628136 2.977188 -0.513995
H 5.559994 1.997664 0.463517
H 5.989161 0.609640 1.463036
H 7.671493 -0.139910 -0.303352
H 7.247826 1.257337 -1.295748
H -7.711735 1.950796 0.062263
H 9.352138 1.720538 0.033613
H 8.052027 2.828781 0.553639
H 8.477023 1.415235 1.560118


