%chk=000029436.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029436

0 1
 O    2.713300      0.8102000     -0.3746000    
 O    2.012100      -1.270700      0.5330000    
 O   -1.992300      3.2400001E-02  0.4265000    
 C   0.3468000      0.4734000      0.1347000    
 C   -1.066700      0.7124000     -0.4088000    
 C    1.386000       1.151600     -0.7775000    
 C   0.6487000      -1.036500      0.1772000    
 C   0.4490000       1.059300       1.556300    
 C   -1.381000       2.195500     -0.4300000    
 C    2.897000     -0.6073000     -0.3728000    
 C   -3.127900     -0.4117000     -0.3044000    
 C    4.319900     -0.8901000      7.8199998E-02
 C   -2.865900      -1.804100     -0.8551000    
 C   -4.339100     -0.4144000      0.6174000    
 H   -1.110600      0.3264000      -1.436400    
 H    1.252400      0.8617000      -1.827200    
 H    1.330300       2.242600     -0.7286000    
 H   2.7100001E-02  -1.548000      0.9200000    
 H   0.4551000      -1.511500     -0.7926000    
 H    1.403200      0.7924000       2.026000    
 H   0.4076000       2.153100       1.563700    
 H  -0.3401000      0.6817000       2.215400    
 H  -0.6853000       2.785700      -1.029900    
 H   -2.372200       2.353100     -0.8725000    
 H   -1.458200       2.626900      0.5727000    
 H    2.757700      -1.002900      -1.387400    
 H   -3.354700      0.2689000      -1.134800    
 H    4.517500      -1.966400      0.1007000    
 H    5.044600     -0.4025000     -0.5814000    
 H    4.486700     -0.5048000       1.090600    
 H   -3.742800      -2.195400      -1.380200    
 H   -2.024500      -1.801800      -1.555200    
 H   -2.601300      -2.499300     -5.0500002E-02
 H   -5.240500     -0.7469000      9.3800001E-02
 H   -4.516400      0.5913000       1.013800    
 H   -4.172800      -1.067300       1.481500    


%chk=000029436-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029436

0 1
O 2.812865 0.802298 -0.325214
O 2.024572 -1.280238 0.606637
O -2.005863 0.058260 0.396818
C 0.366322 0.556085 0.175935
C -1.038072 0.779450 -0.462416
C 1.451441 1.176534 -0.751426
C 0.634207 -0.978457 0.214671
C 0.463196 1.137720 1.605061
C -1.456842 2.255380 -0.603829
C 2.967893 -0.655429 -0.319565
C -3.230001 -0.422321 -0.292488
C 4.376004 -0.979340 0.141878
C -2.952199 -1.743961 -1.036613
C -4.287480 -0.577580 0.807779
H -1.029696 0.308238 -1.473441
H 1.290631 0.842070 -1.804120
H 1.439944 2.277677 -0.717418
H -0.002092 -1.469123 0.964279
H 0.429684 -1.424122 -0.787107
H 1.400543 0.802576 2.079237
H 0.464960 2.242886 1.597379
H -0.390221 0.793009 2.213805
H -0.778085 2.807169 -1.280251
H -2.474993 2.328105 -1.027282
H -1.462513 2.756016 0.378535
H 2.744362 -1.030319 -1.350441
H -3.564099 0.349290 -1.020947
H 4.524459 -2.071617 0.163120
H 5.113073 -0.523991 -0.539994
H 4.531388 -0.577769 1.156737
H -3.860458 -2.091967 -1.563170
H -2.150601 -1.627694 -1.789104
H -2.642879 -2.524228 -0.318482
H -5.236571 -0.958105 0.388405
H -4.477960 0.390655 1.301182
H -3.932218 -1.290156 1.573450


