%chk=000126825.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126825

0 1
 O  -0.9630000     -0.4441000      0.2130000    
 O  -0.1700000       1.357600     -0.9803000    
 C   -5.173200      0.3525000      5.2200001E-02
 C   -4.647900      -1.063000     -0.2819000    
 C   -4.171800       1.418700     -0.4492000    
 C   -2.262200     -0.2316000     -0.3294000    
 C   -3.215600      -1.304300      0.1911000    
 C   -2.740200       1.174600      2.3900000E-02
 C   -5.403900      0.4989000       1.569100    
 C   -6.524800      0.5643000     -0.6551000    
 C   8.8000000E-03  0.4322000     -0.1985000    
 C    1.325300      0.1208000      0.5065000    
 C    1.828000      -1.297900      0.2737000    
 C    2.405700       1.160000      0.2354000    
 C    2.577700      -1.908700       1.257400    
 C    3.244000      0.9824000     -0.8454000    
 C    1.518200      -1.927800     -0.9137000    
 C    2.511800       2.245600       1.079400    
 C    3.038500      -3.207900       1.044100    
 C    4.233500       1.933800      -1.093400    
 C    1.978800      -3.227100      -1.127100    
 C    3.501100       3.197000      0.8314000    
 C    2.739000      -3.867100     -0.1481000    
 C    4.362100       3.041000     -0.2550000    
 H   -4.679800      -1.215600      -1.369200    
 H   -5.305100      -1.825200      0.1550000    
 H   -4.492900       2.418000     -0.1287000    
 H   -4.173300       1.432000      -1.547600    
 H   -2.198500     -0.3341000      -1.421400    
 H   -3.172100      -1.344100       1.286300    
 H   -2.874300      -2.290900     -0.1463000    
 H   -2.141900       1.975200     -0.4120000    
 H   -2.665800       1.326200       1.108200    
 H   -4.486500      0.3598000       2.148100    
 H   -5.795900       1.493300       1.811500    
 H   -6.131000     -0.2388000       1.927400    
 H   -7.263600     -0.1754000     -0.3265000    
 H   -6.930600       1.559900     -0.4431000    
 H   -6.423600      0.4718000      -1.742300    
 H    1.074900      0.1902000       1.577400    
 H    2.816200      -1.402500       2.187800    
 H    3.160500      0.1490000      -1.533100    
 H   0.9428000      -1.448200      -1.699200    
 H    1.844600       2.377200       1.925900    
 H    3.630800      -3.706100       1.806000    
 H    4.900500       1.815600      -1.942500    
 H    1.749000      -3.739200      -2.056900    
 H    3.600600       4.059900       1.483500    
 H    3.098500      -4.878300     -0.3147000    
 H    5.131600       3.782600     -0.4490000    


%chk=000126825-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126825

0 1
O -1.060384 -0.434429 0.493595
O -0.061215 -0.326400 -1.611564
C -5.251336 0.740430 0.072205
C -4.864574 -0.753333 0.305135
C -4.176164 1.398698 -0.846928
C -2.423159 -0.277157 -0.131108
C -3.417497 -0.948749 0.822643
C -2.725885 1.216794 -0.334208
C -5.356944 1.497416 1.423429
C -6.627996 0.800146 -0.637568
C 0.035275 -0.425734 -0.365089
C 1.336685 -0.529186 0.442337
C 2.181163 -1.757429 0.065896
C 2.109708 0.799202 0.312849
C 2.948305 -2.375737 1.087016
C 2.811859 1.134450 -0.871613
C 2.254588 -2.276179 -1.251882
C 2.099857 1.718205 1.391153
C 3.774007 -3.484840 0.802199
C 3.495158 2.366046 -0.970873
C 3.077729 -3.389927 -1.535824
C 2.785211 2.950717 1.293478
C 3.841641 -3.997727 -0.514089
C 3.485988 3.278214 0.110644
H -4.979489 -1.299145 -0.655014
H -5.576897 -1.214170 1.017472
H -4.394723 2.478779 -0.959947
H -4.257147 0.952799 -1.860575
H -2.398705 -0.791091 -1.112116
H -3.300340 -0.511666 1.832455
H -3.184550 -2.026343 0.908612
H -2.011124 1.648273 -1.058110
H -2.583513 1.745040 0.627823
H -4.407581 1.490384 1.987369
H -5.639008 2.554020 1.255175
H -6.131938 1.038811 2.066482
H -7.415431 0.328487 -0.019191
H -6.931249 1.846987 -0.829747
H -6.598525 0.272257 -1.610021
H 1.031992 -0.634626 1.497577
H 2.901937 -1.981765 2.109978
H 2.822627 0.433725 -1.712411
H 1.658001 -1.816881 -2.046952
H 1.552440 1.469346 2.308823
H 4.359164 -3.948966 1.604249
H 4.035628 2.614573 -1.891286
H 3.120696 -3.782701 -2.558174
H 2.772537 3.650721 2.136605
H 4.479019 -4.860513 -0.738152
H 4.019157 4.232376 0.031944


