%chk=000113412.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113412

0 1
 O    1.169900      -1.755500      0.5559000    
 C   -1.417900      0.7157000     -2.0600000E-02
 C  -0.6700000     -0.5674000     -0.4988000    
 C  -0.4933000       1.947300     -0.2178000    
 C   -1.456300      -1.868200     -0.3009000    
 C   -2.683000      0.9510000     -0.8744000    
 C   0.8432000       1.828500      0.5114000    
 C   0.7164000     -0.6906000      0.1423000    
 C   -1.855300      0.6113000       1.455200    
 C    1.541000      0.5503000      0.1768000    
 C  -0.7375000      -3.031200     -0.9764000    
 C   -1.658400      -2.145800       1.185000    
 C   -3.380500       2.224600     -0.4593000    
 C    2.844400      0.4498000     -0.1116000    
 C    3.755500       1.642900     -0.1024000    
 C    3.482000     -0.8628000     -0.4644000    
 H  -0.4775000     -0.4556000      -1.576800    
 H  -0.9593000       2.867900      0.1497000    
 H  -0.3019000       2.096500      -1.289500    
 H   -2.436300      -1.790800     -0.7833000    
 H   -3.392900      0.1246000     -0.7611000    
 H   -2.427700       1.004300      -1.939700    
 H   0.6834000       1.871300       1.595500    
 H    1.425600       2.715700      0.2471000    
 H   -1.091200      0.1794000       2.104900    
 H   -1.998100       1.617600       1.873100    
 H   -2.823200      0.1264000       1.592400    
 H   6.3800000E-02  -3.478500     -0.3836000    
 H   -1.455600      -3.842500      -1.150900    
 H  -0.3380000      -2.750800      -1.956800    
 H  -0.8571000      -1.838200       1.857000    
 H   -1.734800      -3.233100       1.331200    
 H   -2.626200      -1.793600       1.544000    
 H   -3.647700       2.262500      0.5992000    
 H   -2.821400       3.126000     -0.7232000    
 H   -4.326400       2.298300      -1.010400    
 H    3.837400       2.066700      -1.108100    
 H    3.447200       2.426300      0.5946000    
 H    4.760200       1.346200      0.2211000    
 H    3.749300      -1.423500      0.4368000    
 H    2.866100      -1.477300      -1.128600    
 H    4.410500     -0.6904000      -1.022500    


%chk=000113412-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113412

0 1
O 1.103061 -1.719173 0.731474
C -1.432441 0.772856 0.065711
C -0.714290 -0.551562 -0.445628
C -0.552717 1.941781 -0.467507
C -1.526042 -1.888673 -0.436846
C -2.860219 0.864339 -0.560729
C 0.895223 1.932669 0.075893
C 0.696756 -0.650430 0.173927
C -1.520631 0.855745 1.616538
C 1.578693 0.560151 0.073525
C -0.812387 -2.973879 -1.288631
C -1.888786 -2.463205 0.956237
C -3.635152 2.174669 -0.293178
C 2.953755 0.437221 0.025815
C 3.869618 1.652275 -0.010742
C 3.707491 -0.879221 -0.030069
H -0.528449 -0.342636 -1.526697
H -1.012345 2.911557 -0.198117
H -0.535700 1.890702 -1.575789
H -2.477725 -1.663856 -0.960318
H -3.468997 0.022537 -0.177992
H -2.774306 0.715078 -1.657908
H 0.881830 2.312924 1.119250
H 1.486366 2.661266 -0.507644
H -0.571961 0.567637 2.103406
H -1.759641 1.887329 1.936285
H -2.306854 0.193246 2.015800
H 0.103257 -3.324917 -0.785315
H -1.481716 -3.842130 -1.437661
H -0.535209 -2.586996 -2.288849
H -0.979629 -2.641704 1.552803
H -2.414967 -3.428970 0.831922
H -2.559406 -1.795477 1.524975
H -3.767057 2.357864 0.788558
H -3.130815 3.055845 -0.728606
H -4.643576 2.117668 -0.743149
H 4.200346 1.862891 -1.048686
H 3.407346 2.567545 0.390581
H 4.785968 1.446174 0.573345
H 4.024606 -1.182952 0.986980
H 3.101248 -1.709392 -0.420754
H 4.623856 -0.761498 -0.640110


