%chk=000101116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101116

0 1
 O  -0.6634000      4.6900000E-02  0.2212000    
 O   -2.643100      -1.833700     -0.7018000    
 C   -2.790000      0.5861000     -0.7244000    
 C   -3.177200       1.462200      0.4709000    
 C   -4.678500       1.409300      0.7506000    
 C   -5.139000     -2.4700001E-02  0.9981000    
 C   -1.278800      0.5930000     -0.9312000    
 C   -4.795700     -0.9353000     -0.1718000    
 C   -3.325500     -0.8272000     -0.5158000    
 C   0.7543000      2.1199999E-02  9.9799998E-02
 C    1.260100     -0.5940000       1.422200    
 C    1.032800     -0.8941000      -1.113200    
 C    1.228500       1.474400     -0.1256000    
 C    2.596600     -0.8707000       1.535600    
 C    1.060800      -2.247100     -0.9063000    
 C    2.411100       1.670600     -0.7867000    
 C   0.3464000     -0.8321000       2.414100    
 C    1.237500     -0.3044000      -2.331500    
 C   0.4416000       2.489300      0.3480000    
 C    3.053600      -1.427100       2.730300    
 C    1.312800      -3.073500      -2.001400    
 C    2.839500       2.982500     -0.9898000    
 C   0.8033000      -1.388400       3.608900    
 C    1.489400      -1.130800      -3.426700    
 C   0.8699000       3.801200      0.1449000    
 C    2.156900      -1.685900       3.766900    
 C    1.527000      -2.515400      -3.261500    
 C    2.068900       4.047700     -0.5240000    
 H   -3.270500      0.9724000      -1.632800    
 H   -2.886100       2.501800      0.2803000    
 H   -2.648500       1.139800       1.376600    
 H   -5.228700       1.834700     -9.7499996E-02
 H   -4.910400       2.025600       1.626500    
 H   -6.220400     -4.1099999E-02   1.173300    
 H   -4.659400     -0.4037000       1.909300    
 H  -0.9920000       1.602100      -1.229900    
 H   -1.135900     -5.1800001E-02  -1.803000    
 H   -5.374200     -0.6662000      -1.062100    
 H   -5.029100      -1.974200      8.3999999E-02
 H    3.308700     -0.6808000      0.7404000    
 H   0.8640000      -2.719000      4.9500000E-02
 H    3.080800      0.8748000      -1.094500    
 H  -0.7129000     -0.6122000       2.347000    
 H    1.116300      0.7471000      -2.560500    
 H  -0.4571000       2.336900      0.9339000    
 H    4.107300      -1.659800       2.853100    
 H    1.332500      -4.152100      -1.875200    
 H    3.782500       3.174600      -1.493400    
 H   0.1061000      -1.588500       4.417300    
 H    1.631300     -0.6989000      -4.413200    
 H   0.2788000       4.630500      0.5227000    
 H    2.512600      -2.118900       4.697200    
 H    1.715300      -3.159200      -4.115700    
 H    2.406500       5.068900     -0.6748000    


%chk=000101116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101116

0 1
O -0.739856 0.092295 0.071420
O -2.990323 -1.958822 -0.867095
C -2.977368 0.498636 -0.767374
C -3.265880 1.455838 0.426895
C -4.757625 1.465657 0.824230
C -5.235639 0.042172 1.186137
C -1.489676 0.431851 -1.146468
C -5.022814 -0.931709 -0.001992
C -3.594781 -0.900421 -0.552157
C 0.749210 0.043754 -0.052089
C 1.225654 -0.520718 1.311965
C 1.130071 -0.900731 -1.216898
C 1.300507 1.487956 -0.191146
C 2.611857 -0.592949 1.601114
C 1.219807 -2.297856 -0.992232
C 2.559675 1.768365 -0.781109
C 0.302080 -0.985749 2.277698
C 1.269132 -0.423485 -2.546995
C 0.580541 2.557850 0.398843
C 3.065363 -1.114158 2.830992
C 1.468750 -3.189391 -2.057157
C 3.076294 3.083424 -0.794109
C 0.755758 -1.503580 3.513450
C 1.520616 -1.312333 -3.615013
C 1.092052 3.872972 0.383935
C 2.137765 -1.570033 3.797353
C 1.626989 -2.700825 -3.374236
C 2.344250 4.143992 -0.214697
H -3.514315 0.911252 -1.653676
H -2.930138 2.475049 0.152547
H -2.652623 1.134912 1.289407
H -5.369842 1.858645 -0.014410
H -4.912376 2.149191 1.680905
H -6.304680 0.047487 1.471200
H -4.668636 -0.322189 2.065761
H -1.151989 1.414286 -1.540051
H -1.332467 -0.347048 -1.915240
H -5.701344 -0.633397 -0.830436
H -5.269187 -1.974315 0.264172
H 3.343318 -0.241503 0.865810
H 1.087131 -2.689254 0.021157
H 3.142300 0.961119 -1.238046
H -0.764357 -0.945981 2.045775
H 1.178292 0.648446 -2.753085
H -0.378315 2.341891 0.880454
H 4.140913 -1.162199 3.036005
H 1.532951 -4.265213 -1.859601
H 4.051317 3.276944 -1.255852
H 0.026840 -1.860171 4.250509
H 1.627103 -0.920704 -4.633090
H 0.518536 4.684479 0.846606
H 2.489037 -1.972174 4.754451
H 1.822505 -3.392627 -4.201372
H 2.744916 5.163874 -0.224869


