%chk=000135624.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135624

0 1
 O   -4.474100       1.332200      0.4177000    
 O   -4.625800      -1.641400      0.8743000    
 O  -0.7694000      -2.242200     -0.5759000    
 O   -2.654500      -1.274400       2.021600    
 O   0.4458000       3.012100      0.6045000    
 O    1.698100      -2.708400     -0.6395000    
 O    2.881200       2.375500      0.5008000    
 O    5.397100       1.889100      0.4651000    
 C   -3.850600      0.6048000     -0.6504000    
 C   -3.494700       2.037100     -0.3543000    
 C   -2.918700     -0.4967000     -0.2410000    
 C   -2.246100       2.360300      0.3960000    
 C   -4.792100      0.3214000      -1.767900    
 C   -1.485800     -1.3300000E-02 -0.1359000    
 C   -1.171700       1.327900      0.1561000    
 C   -3.354100      -1.172600       1.022900    
 C   -4.091200      0.2427000      -3.126700    
 C  -0.4432000     -0.9412000     -0.3063000    
 C   0.1739000       1.710400      0.2847000    
 C   0.8947000     -0.5464000     -0.1907000    
 C    1.203100      0.7789000      0.1061000    
 C    1.969200      -1.542900     -0.3780000    
 C    2.609900       1.210000      0.2398000    
 C    3.376200      -1.113400     -0.2460000    
 C    3.685400      0.2151000      5.2499998E-02
 C   -5.170100      -2.314400       2.014100    
 C    5.022900      0.6101000      0.1757000    
 C    4.404400      -2.047200     -0.4215000    
 C    6.044500     -0.3237000      1.9999999E-04
 C    5.735900      -1.649400     -0.2980000    
 H   -3.837900       2.828100      -1.006500    
 H   -2.944000      -1.270900      -1.018900    
 H   -2.446500       2.421100       1.472600    
 H   -1.939700       3.356100      6.4499997E-02
 H   -5.566200       1.097400      -1.828100    
 H   -5.320800     -0.6213000      -1.584700    
 H   -3.561500       1.175700      -3.345600    
 H   -3.362100     -0.5724000      -3.157900    
 H   -4.825400      7.0600003E-02  -3.919800    
 H  -1.5900001E-02  -2.828300     -0.4112000    
 H  -2.0800000E-02   3.587500     -2.4000000E-02
 H   -4.568700      -3.195700       2.256400    
 H   -6.184000      -2.638600       1.765200    
 H   -5.219000      -1.632300       2.868200    
 H    4.190100      -3.086800     -0.6544000    
 H    7.085200     -2.4900001E-02  9.4200000E-02
 H    6.533200      -2.374400     -0.4343000    
 H    4.621000       2.459400      0.5691000    


%chk=000135624-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135624

0 1
O -4.601928 1.336411 0.466148
O -4.516817 -1.801021 0.883532
O -0.779510 -2.187415 -0.623712
O -2.799466 -0.919177 2.188788
O 0.507581 3.094955 0.662906
O 1.627322 -2.748326 -0.688886
O 3.070778 2.450925 0.538672
O 5.495654 1.837862 0.486653
C -3.922858 0.623962 -0.698674
C -3.584304 2.052694 -0.387930
C -2.910309 -0.449737 -0.263772
C -2.273650 2.426014 0.296099
C -4.847849 0.278893 -1.855848
C -1.484327 0.053386 -0.160609
C -1.171456 1.385146 0.135882
C -3.357347 -1.059649 1.083200
C -4.100367 0.170888 -3.206043
C -0.430847 -0.894898 -0.331220
C 0.201995 1.784299 0.307610
C 0.936094 -0.499027 -0.205760
C 1.267838 0.864099 0.123070
C 1.967055 -1.520806 -0.401563
C 2.691427 1.240297 0.256468
C 3.384908 -1.148102 -0.267395
C 3.720040 0.203652 0.054872
C -5.120580 -2.385481 2.106810
C 5.108070 0.560360 0.182289
C 4.391530 -2.118407 -0.455947
C 6.113650 -0.427399 -0.009740
C 5.752994 -1.749178 -0.324842
H -4.033970 2.832466 -1.016889
H -2.936669 -1.280633 -0.990335
H -2.486726 2.591174 1.372670
H -1.946431 3.397318 -0.128744
H -5.631107 1.057410 -1.916795
H -5.358174 -0.675082 -1.623930
H -3.617358 1.127406 -3.478352
H -3.315989 -0.607757 -3.180099
H -4.803341 -0.095526 -4.014835
H 0.130615 -2.721346 -0.714724
H -0.313867 3.618863 0.845539
H -4.406603 -3.073007 2.589913
H -6.011328 -2.921481 1.751298
H -5.392185 -1.582580 2.811956
H 4.094776 -3.141881 -0.700193
H 7.159318 -0.124324 0.095190
H 6.536656 -2.499967 -0.470241
H 4.614260 2.394024 0.582311


