%chk=000170401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170401

0 1
 O   0.6565000       1.089000     -0.2962000    
 O    1.484300       2.494100       1.340000    
 C   0.4928000     -2.9000000E-03  0.6106000    
 C    1.872800     -0.5450000       1.010700    
 C    2.674500      -1.036100     -0.2003000    
 C  -0.3880000      -1.058200     -7.4100003E-02
 C    4.054300      -1.544400      0.2185000    
 C   -1.852200     -0.7050000     -0.1083000    
 C    4.843900      -2.059300     -0.9745000    
 C   -2.674400      -1.101000      0.9367000    
 C   -2.356600      1.0800000E-02  -1.184600    
 C    1.392100       2.137900      0.1730000    
 C   -4.030200     -0.7744000      0.9048000    
 C   -3.712300      0.3376000      -1.216400    
 C   -4.549100     -5.5199999E-02 -0.1717000    
 C    2.091600       2.812300     -0.9680000    
 H  -1.7000001E-02  0.3609000       1.512800    
 H    1.737400      -1.375500       1.715100    
 H    2.459900      0.2116000       1.541700    
 H    2.796100     -0.2342000     -0.9356000    
 H    2.139800      -1.852200     -0.6991000    
 H  -5.2700002E-02  -1.225900      -1.106200    
 H  -0.2807000      -2.022600      0.4399000    
 H    4.617500     -0.7372000      0.7012000    
 H    3.947500      -2.350900      0.9533000    
 H    4.995500      -1.268000      -1.715600    
 H    4.323400      -2.890700      -1.460600    
 H    5.827300      -2.416100     -0.6526000    
 H   -2.279700      -1.659300       1.780800    
 H   -1.713900      0.3224000      -2.003000    
 H   -4.681600      -1.079500       1.718600    
 H   -4.116400      0.8980000      -2.054400    
 H   -5.604600      0.1994000     -0.1964000    
 H    1.364800       3.099700      -1.732200    
 H    2.849100       2.147500      -1.388700    
 H    2.582700       3.719800     -0.6048000    


%chk=000170401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170401

0 1
O 0.819155 0.936225 -0.341183
O 1.192668 2.441121 1.406226
C 0.663736 -0.190688 0.645735
C 2.053240 -0.755984 1.002185
C 2.853921 -1.347596 -0.179358
C -0.294047 -1.199946 -0.025113
C 4.278592 -1.778925 0.237474
C -1.724329 -0.690742 -0.127764
C 5.093400 -2.371424 -0.932084
C -2.653904 -0.930719 0.917164
C -2.150694 0.060496 -1.253105
C 1.061343 2.210187 0.182271
C -3.974055 -0.431475 0.843606
C -3.470112 0.560739 -1.331830
C -4.386909 0.317238 -0.282752
C 1.109543 3.236451 -0.930066
H 0.202738 0.238584 1.555704
H 1.907478 -1.534628 1.779779
H 2.637269 0.054349 1.479918
H 2.918524 -0.596182 -0.991403
H 2.323941 -2.224977 -0.602648
H 0.101450 -1.445603 -1.027272
H -0.261935 -2.128620 0.577095
H 4.814769 -0.903776 0.657871
H 4.210768 -2.523650 1.057217
H 5.205623 -1.634873 -1.750060
H 4.593801 -3.264678 -1.352796
H 6.106392 -2.672857 -0.607898
H -2.343549 -1.516428 1.792126
H -1.439903 0.255800 -2.064268
H -4.679208 -0.629073 1.659078
H -3.783954 1.136933 -2.209957
H -5.410926 0.702781 -0.343448
H 0.081809 3.448299 -1.277176
H 1.679483 2.852291 -1.791717
H 1.558283 4.168748 -0.557151


