%chk=000066501.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066501

0 1
 O   -2.561400     -0.5657000       1.170400    
 O    2.560000     -0.5670000       1.170400    
 O  -7.9999998E-04 -0.4870000       1.136800    
 O   3.0000001E-04   4.412800     -0.9965000    
 C   -1.273600       1.322100      0.3474000    
 C    1.272500       1.322000      0.3485000    
 C   -1.273200       2.602600     -0.2100000    
 C    1.272900       2.602500     -0.2085000    
 C  -7.9999998E-04  0.6350000      0.6468000    
 C    0.000000       3.289400     -0.5086000    
 C   -2.487300      0.6820000      0.6256000    
 C    2.485900      0.6817000      0.6276000    
 C   -2.486600       3.243000     -0.4889000    
 C    2.486500       3.242900     -0.4861000    
 C   -3.694100       1.323700      0.3458000    
 C    3.693100       1.323400      0.3492000    
 C   -3.693700       2.601500     -0.2100000    
 C    3.693400       2.601200     -0.2065000    
 C   -3.207200      -1.547200      0.4395000    
 C    3.207500      -1.546800      0.4389000    
 C   -2.939300      -1.668200     -0.9126000    
 C    2.941800      -1.665500     -0.9139000    
 C   -4.105400      -2.383200       1.079000    
 C    4.104600      -2.383900       1.078400    
 C   -3.591100      -2.657100      -1.649300    
 C    3.594100      -2.653800      -1.651000    
 C   -4.757000      -3.372200      0.3422000    
 C    4.757000      -3.372100      0.3411000    
 C   -4.499700      -3.509200      -1.022000    
 C    4.501700      -3.507000      -1.023600    
 H   -2.513300       4.239400     -0.9217000    
 H    2.513700       4.239400     -0.9187000    
 H   -4.647600      0.8509000      0.5670000    
 H    4.646300      0.8503000      0.5709000    
 H   -4.634600       3.100400     -0.4239000    
 H    4.634400       3.100000     -0.4193000    
 H   -2.222000      -1.030700      -1.420600    
 H    2.225300      -1.027200      -1.422000    
 H   -4.307000      -2.277400       2.140700    
 H    4.304400      -2.280000       2.140600    
 H   -3.387600      -2.766800      -2.710600    
 H    3.392100      -2.762000      -2.712600    
 H   -5.464600      -4.035800      0.8306000    
 H    5.463500      -4.036600      0.8297000    
 H   -5.006300      -4.280000      -1.595400    
 H    5.008800      -4.277200      -1.597400    


%chk=000066501-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066501

0 1
O -2.503267 -0.668300 0.656193
O 2.503431 -0.667773 0.656580
O 0.000198 -0.695229 -0.512593
O -0.000362 4.701325 -0.749513
C -1.277411 1.304212 -0.034466
C 1.277295 1.304485 -0.034254
C -1.280914 2.715395 -0.261750
C 1.280534 2.715668 -0.261538
C 0.000038 0.525835 -0.178955
C -0.000253 3.462100 -0.462527
C -2.523902 0.666286 0.226264
C 2.523878 0.666819 0.226671
C -2.493057 3.443808 -0.294514
C 2.492526 3.444339 -0.294102
C -3.735896 1.398368 0.200566
C 3.735722 1.399160 0.201169
C -3.717356 2.781650 -0.073731
C 3.716930 2.782440 -0.073122
C -3.466744 -1.606571 0.207088
C 3.467213 -1.605849 0.207718
C -4.045498 -1.549660 -1.081319
C 4.046185 -1.548899 -1.080590
C -3.753974 -2.664967 1.095487
C 3.754512 -2.664125 1.096237
C -4.942372 -2.569567 -1.470408
C 4.943346 -2.568640 -1.469453
C -4.648802 -3.678225 0.689359
C 4.649630 -3.677218 0.690336
C -5.251011 -3.633262 -0.590747
C 5.252056 -3.632210 -0.589666
H -2.444962 4.519514 -0.487278
H 2.444236 4.520035 -0.486869
H -4.677412 0.884625 0.417869
H 4.677313 0.885618 0.418622
H -4.658323 3.341141 -0.090434
H 4.657781 3.342130 -0.089671
H -3.785244 -0.742416 -1.773048
H 3.785879 -0.741758 -1.772419
H -3.269988 -2.682729 2.076285
H 3.270351 -2.681928 2.076948
H -5.389494 -2.536471 -2.470072
H 5.390638 -2.535515 -2.469040
H -4.874423 -4.503171 1.373840
H 4.875306 -4.502070 1.374910
H -5.944415 -4.421488 -0.901958
H 5.945683 -4.420309 -0.900703


