%chk=000160467.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160467

0 1
 O    2.374500      0.7117000      -1.566600    
 O   0.9234000       2.768600     -0.6658000    
 O    1.774700      -1.753800     -0.9058000    
 O   -1.832800     -0.4110000       1.585200    
 O   -1.770000       2.960200       1.378700    
 C    1.798300      0.5705000     -0.2689000    
 C   0.3527000      -1.174700      0.9529000    
 C    1.332900     -0.8758000     -0.1644000    
 C   0.6256000       1.516400     -0.1501000    
 C  -0.5631000       1.199400      0.4067000    
 C    2.868700      0.8609000      0.7825000    
 C  -0.7724000     -0.1567000       1.012100    
 C  -0.2130000      -2.587700      0.8243000    
 C   -1.672300       2.171900      0.4396000    
 C   -2.626100       2.163000     -0.7440000    
 C   -3.853500       1.263100     -0.5321000    
 C    3.968400     -0.1560000      0.7273000    
 C   -1.129900      -2.696800     -0.3566000    
 C    5.122200     -8.4700003E-02  3.6800001E-02
 C   -4.616700       1.703500      0.7184000    
 C   -4.785700       1.295000      -1.745900    
 C   -2.446500      -2.979300     -0.3541000    
 C    6.188700      -1.142900      2.3499999E-02
 C    5.437600       1.127300     -0.7987000    
 C   -3.312800      -3.074400      -1.577900    
 C   -3.173000      -3.217800      0.9427000    
 H   0.9100000      -1.105600       1.895300    
 H    3.263200       1.876900      0.6740000    
 H    2.438900      0.8280000       1.792700    
 H   0.6014000      -3.310900      0.6863000    
 H  -0.6780000      -2.873500       1.769400    
 H   -2.078000       1.843700      -1.639100    
 H   -2.928500       3.201200     -0.9308000    
 H   -3.523400      0.2281000     -0.3870000    
 H    3.795100      -1.054000       1.319400    
 H    1.664800      0.6284000      -2.226700    
 H  -0.6662000      -2.544800      -1.330000    
 H   0.1532000       3.349400     -0.5519000    
 H   -4.898900       2.760500      0.6634000    
 H   -5.535300       1.117700      0.8345000    
 H   -4.027200       1.551800       1.627500    
 H   -4.257300      0.9631000      -2.645800    
 H   -5.165800       2.305800      -1.928700    
 H   -5.642900      0.6303000      -1.596500    
 H    6.347400      -1.512200     -0.9947000    
 H    7.133000     -0.7386000      0.4016000    
 H    5.915500      -1.997900      0.6506000    
 H    4.658700       1.889600     -0.8351000    
 H    5.626400      0.8214000      -1.833800    
 H    6.344500       1.611100     -0.4195000    
 H   -3.762900      -4.069500      -1.650600    
 H   -4.113300      -2.328600      -1.538400    
 H   -2.738000      -2.898900      -2.493200    
 H   -2.615700      -3.012300       1.855100    
 H   -3.506000      -4.260500      0.9902000    
 H   -4.064300      -2.580500      0.9836000    


%chk=000160467-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160467

0 1
O 2.722133 0.428021 -1.878668
O 0.593699 2.122267 -1.954493
O 2.051700 -2.071181 -1.262191
O -1.981408 -0.754521 0.922885
O -1.747014 2.632302 -1.696957
C 1.733646 0.281509 -0.839672
C 0.210161 -1.525045 0.263677
C 1.365733 -1.200868 -0.660096
C 0.470922 1.078868 -1.186830
C -0.808529 0.726149 -0.592142
C 2.313500 0.874503 0.523297
C -0.947982 -0.486410 0.233058
C -0.334000 -2.978837 0.088502
C -1.930909 1.587286 -0.876703
C -3.320884 1.438958 -0.338244
C -3.482624 2.041985 1.104457
C 3.503944 0.104987 1.044730
C -0.931941 -3.239804 -1.281159
C 4.821293 0.391985 0.823882
C -3.275923 3.573187 1.113703
C -4.877621 1.659760 1.648770
C -2.238962 -3.498807 -1.577908
C 5.911353 -0.467903 1.441977
C 5.318918 1.555977 -0.012238
C -2.661425 -3.784691 -3.011162
C -3.368512 -3.547794 -0.562856
H 0.621514 -1.453266 1.297993
H 2.572761 1.920571 0.285046
H 1.507353 0.896293 1.281492
H 0.518107 -3.666647 0.250351
H -1.067812 -3.153383 0.891477
H -3.581373 0.369028 -0.277728
H -4.007633 1.965494 -1.025679
H -2.720889 1.562725 1.748497
H 3.272766 -0.776793 1.662722
H 3.055411 -0.493710 -2.079612
H -0.205762 -3.245598 -2.106733
H -0.675113 2.631387 -1.997408
H -4.032873 4.076266 0.482566
H -3.375365 3.966100 2.142430
H -2.280738 3.862969 0.732048
H -4.995583 0.562438 1.705740
H -5.680167 2.063527 1.001785
H -5.024193 2.072691 2.663886
H 6.536844 -0.933803 0.655236
H 6.592401 0.146066 2.063919
H 5.498255 -1.273080 2.073794
H 4.516646 2.057101 -0.573453
H 6.063633 1.201729 -0.751088
H 5.836199 2.299937 0.626484
H -3.153967 -4.774699 -3.087710
H -3.400434 -3.037513 -3.363510
H -1.803021 -3.774257 -3.704755
H -3.081894 -3.150502 0.423246
H -3.731001 -4.587603 -0.433827
H -4.233043 -2.956250 -0.923228


