%chk=000034085.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034085

0 1
 O   -2.299600      0.4784000      -1.327100    
 O    6.389500      0.4620000      0.1021000    
 C   -2.006000      4.6999999E-03   1.081300    
 C   -1.091700      -1.222500      0.8025000    
 C   0.1826000     -0.9467000     -3.8500000E-02
 C   -2.962700      8.9999996E-03 -0.1518000    
 C   0.9492000      0.3035000      0.4491000    
 C   -1.216200       1.310700       1.299400    
 C   -2.020400      -2.237100      9.4999999E-02
 C   1.2600000E-02   1.518000      0.4227000    
 C   -3.264300      -1.477200     -0.3768000    
 C    2.244800      0.5588000     -0.3879000    
 C    1.122200      -2.169300     -2.6000000E-03
 C   -2.801200     -0.2570000       2.391900    
 C   -4.250400      0.8204000     -3.7000000E-03
 C    2.341700      -1.954400     -0.8878000    
 C    3.086900     -0.7016000     -0.5124000    
 C    3.054500       1.727000      0.2154000    
 C   -5.136000      0.6778000      -1.235800    
 C    4.463500       1.817000     -0.3445000    
 C    4.418800     -0.7378000     -0.3483000    
 C    5.186500      0.5114000     -0.1429000    
 C   -6.404200       1.505100      -1.099300    
 H  -0.7592000      -1.652700       1.757300    
 H  -0.1098000     -0.7824000      -1.084500    
 H    1.249300      0.1294000       1.493400    
 H  -0.8622000       1.340700       2.339700    
 H   -1.882100       2.175600       1.192800    
 H   -2.316300      -3.029200      0.7931000    
 H   -1.541300      -2.730400     -0.7565000    
 H  -0.2844000       1.744200     -0.6069000    
 H   0.5271000       2.410700      0.7938000    
 H   -3.474800      -1.728100      -1.422500    
 H   -4.124400      -1.808400      0.2177000    
 H    1.947900      0.8426000      -1.407800    
 H   0.6033000      -3.071600     -0.3430000    
 H    1.444400      -2.363500       1.029000    
 H   -3.449100      -1.136400       2.327200    
 H   -2.118100     -0.4263000       3.233000    
 H   -3.425000      0.6034000       2.658100    
 H   -4.003500       1.880600      0.1301000    
 H   -4.822500      0.5038000      0.8751000    
 H    2.023700      -1.872500      -1.935000    
 H    2.987200      -2.838900     -0.8245000    
 H    3.114000       1.610600       1.306000    
 H    2.547600       2.678900      2.2800000E-02
 H   -2.732900      0.1137000      -2.115900    
 H   -5.427500     -0.3655000      -1.395100    
 H   -4.617500       1.016400      -2.138900    
 H    5.013100       2.608300      0.1767000    
 H    4.453500       2.050400      -1.414600    
 H    4.986600      -1.658100     -0.4294000    
 H   -6.991500       1.184000     -0.2330000    
 H   -6.169700       2.567900     -0.9812000    
 H   -7.028300       1.393200      -1.991600    


%chk=000034085-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034085

0 1
O -2.244834 0.404125 -1.352851
O 6.551340 0.552421 -0.032719
C -2.024283 -0.031422 1.041424
C -1.087048 -1.269324 0.790340
C 0.216301 -0.996348 -0.018191
C -3.026102 -0.076882 -0.172292
C 0.953313 0.289808 0.444836
C -1.259441 1.313417 1.206697
C -1.997217 -2.324250 0.063656
C -0.005161 1.496950 0.326968
C -3.310365 -1.593804 -0.349165
C 2.279998 0.539849 -0.356683
C 1.160789 -2.216282 0.079191
C -2.814383 -0.278213 2.361847
C -4.301002 0.789513 -0.022290
C 2.429090 -2.012316 -0.782657
C 3.144677 -0.715642 -0.459835
C 3.079795 1.728409 0.242567
C -5.220380 0.814121 -1.267768
C 4.499458 1.859738 -0.345929
C 4.510160 -0.685097 -0.319419
C 5.291581 0.561172 -0.194672
C -6.500517 1.644598 -1.025995
H -0.768879 -1.661019 1.779942
H -0.073019 -0.846991 -1.079294
H 1.234591 0.158047 1.515911
H -0.945327 1.391312 2.268890
H -1.959144 2.154736 1.031954
H -2.215534 -3.192542 0.711241
H -1.477108 -2.714896 -0.829356
H -0.306988 1.612916 -0.729486
H 0.500353 2.429650 0.641655
H -3.605940 -1.830228 -1.388475
H -4.154483 -1.898068 0.297351
H 1.971165 0.805917 -1.395925
H 0.643607 -3.139425 -0.246239
H 1.453603 -2.367817 1.138966
H -3.437812 -1.189835 2.320878
H -2.101580 -0.400380 3.197949
H -3.470641 0.576194 2.609128
H -4.004407 1.830930 0.216433
H -4.894358 0.418646 0.835404
H 2.116057 -1.978997 -1.849507
H 3.123198 -2.867011 -0.681340
H 3.155985 1.580698 1.339319
H 2.530760 2.673321 0.082726
H -2.812167 0.285740 -2.156855
H -5.504233 -0.219770 -1.548930
H -4.677884 1.248853 -2.132902
H 5.066768 2.680271 0.127714
H 4.438772 2.090971 -1.430372
H 5.095467 -1.613315 -0.358078
H -7.094858 1.221483 -0.194411
H -6.250040 2.689024 -0.761552
H -7.143992 1.667643 -1.924401


