%chk=000081382.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081382

0 1
 O  -1.7000001E-02  0.3788000       1.761700    
 O    3.266800      -3.475700      -1.923200    
 O   -5.361200      0.1919000      -1.483600    
 C  -1.5300000E-02  0.5447000      0.3087000    
 C   0.9035000     -0.5011000     -0.2432000    
 C   -1.505900      0.3971000     -0.1411000    
 C   0.5003000       2.005800      0.1078000    
 C    2.225700     -0.6441000      0.2084000    
 C   -2.311400     -0.5257000      0.4732000    
 C   0.3954000      -1.340400      -1.234900    
 C   -1.886700       1.237300      -1.148400    
 C    3.043800      -1.652800     -0.3539000    
 C   -3.649700     -0.6102000      2.0600000E-02
 C    1.273900       2.252600     -0.9842000    
 C   0.1404000       2.931000       1.038700    
 C    2.515600      -2.488700      -1.351300    
 C   -4.079600      0.2370000      -1.013800    
 C    2.753800      0.1919000       1.205600    
 C   -1.881400      -1.372900       1.507400    
 C    1.199800      -2.332300      -1.787800    
 C   -3.202700       1.154300      -1.593400    
 C    4.365900      -1.795600      9.7499996E-02
 C   -4.518500      -1.539500      0.6155000    
 C    1.734400       3.557000      -1.163600    
 C   0.6009000       4.235300      0.8591000    
 C    4.069700      3.5700001E-02   1.642100    
 C   -2.758300      -2.290300       2.087100    
 C    4.874200     -0.9562000       1.089200    
 C   -4.074300      -2.373400       1.641900    
 C    1.397900       4.548400     -0.2420000    
 H  -0.6053000      -1.268100      -1.644200    
 H   -1.246000       1.943200      -1.658300    
 H   0.5811000     -0.3286000       2.048900    
 H    1.529400       1.512200      -1.732900    
 H  -0.4947000       2.716000       1.890700    
 H    2.218300      0.9974000       1.689900    
 H  -0.8657000      -1.516300       1.838300    
 H   0.7990000      -2.979400      -2.563600    
 H   -3.531200       1.805900      -2.399000    
 H    5.044200      -2.540500     -0.3086000    
 H   -5.552400      -1.631400      0.2901000    
 H    2.349300       3.802600      -2.024500    
 H   0.3348000       5.008600       1.573800    
 H    4.468500      0.6907000       2.411500    
 H   -2.406800      -2.963800       2.863700    
 H    5.899800      -1.073800       1.426800    
 H   -4.754100      -3.093200       2.088300    
 H    1.754100       5.564600     -0.3832000    
 H    3.945400      -3.786200      -1.304200    
 H   -5.466900      0.8486000      -2.193100    


%chk=000081382-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081382

0 1
O -0.037121 0.718453 1.894863
O 3.367013 -3.487935 -1.871104
O -5.659689 0.300648 -0.973942
C -0.014099 0.674143 0.395840
C 0.915339 -0.456702 -0.121636
C -1.488944 0.511863 -0.065996
C 0.563536 2.049646 -0.017520
C 2.240704 -0.671770 0.427303
C -2.292286 -0.614718 0.387998
C 0.517011 -1.231483 -1.220423
C -2.110165 1.500496 -0.835874
C 3.097104 -1.700467 -0.142825
C -3.710303 -0.654366 0.081929
C 1.194263 2.223109 -1.274279
C 0.426408 3.169247 0.839642
C 2.610530 -2.475380 -1.259481
C -4.283571 0.401590 -0.708991
C 2.773266 0.103352 1.516174
C -1.760334 -1.719431 1.145084
C 1.344236 -2.235809 -1.790283
C -3.493441 1.452080 -1.174415
C 4.407099 -1.913249 0.401302
C -4.526445 -1.732171 0.552132
C 1.682665 3.489644 -1.665874
C 0.920566 4.435010 0.451950
C 4.056511 -0.121662 2.017116
C -2.576340 -2.760967 1.595198
C 4.884916 -1.142761 1.461610
C -3.974155 -2.767213 1.308594
C 1.549658 4.602142 -0.803485
H -0.471562 -1.067996 -1.660065
H -1.523759 2.352505 -1.188454
H -0.681043 0.041546 2.224807
H 1.313112 1.365311 -1.944834
H -0.054608 3.028211 1.810933
H 2.139791 0.869260 1.964408
H -0.681874 -1.789017 1.319022
H 1.003867 -2.830943 -2.642074
H -3.928024 2.254546 -1.783649
H 5.068408 -2.688142 -0.012018
H -5.590482 -1.722038 0.299889
H 2.171572 3.604507 -2.639993
H 0.814079 5.289611 1.130101
H 4.431015 0.488778 2.845983
H -2.133064 -3.588733 2.159670
H 5.889043 -1.317297 1.862872
H -4.604147 -3.587985 1.667356
H 1.934580 5.583402 -1.103797
H 4.249917 -3.593697 -1.439508
H -5.969956 1.071236 -1.510755


