%chk=000004534.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004534

0 1
 O   -6.312700       1.328000     -0.5018000    
 O    6.319800       1.325800      0.4710000    
 O   -6.869600      -1.394000     -0.4109000    
 O    6.871900      -1.397300      0.3878000    
 C  -0.7577000      0.5734000     -0.2034000    
 C   0.7434000      0.5854000      0.2299000    
 C   -1.739900      0.4966000      0.9886000    
 C    1.728700      0.4933000     -0.9613000    
 C   -1.073400       1.787400      -1.093700    
 C    1.117300       1.804200       1.085500    
 C   -3.114700     -6.8999999E-03  0.6127000    
 C    3.105100     -9.3999999E-03 -0.5996000    
 C   -4.085500      0.9015000      0.2249000    
 C    4.083700      0.8989000     -0.2272000    
 C   -3.376200      -1.365800      0.6643000    
 C    3.366100      -1.369700     -0.6465000    
 C   -5.354400      0.4373000     -0.1215000    
 C    5.355900      0.4347000      0.1066000    
 C   -4.645200      -1.829900      0.3181000    
 C    4.638400      -1.833800     -0.3128000    
 C   -5.634300     -0.9283000     -7.4800000E-02
 C    5.633400     -0.9316000      6.3900001E-02
 H  -0.8974000     -0.3267000     -0.8185000    
 H   0.8874000     -0.3057000      0.8572000    
 H   -1.330200     -0.1721000       1.757500    
 H   -1.833800       1.474900       1.477500    
 H    1.313100     -0.1813000      -1.722300    
 H    1.823900       1.464500      -1.464500    
 H  -0.3712000       1.873900      -1.927700    
 H   -1.047300       2.723200     -0.5264000    
 H   -2.067200       1.696900      -1.542200    
 H    1.140500       2.725800      0.4950000    
 H   0.4062000       1.947700       1.904600    
 H    2.098200       1.677000       1.552900    
 H   -3.874800       1.967000      0.1940000    
 H    3.868700       1.963900     -0.2026000    
 H   -2.611500      -2.075500      0.9665000    
 H    2.597300      -2.080400     -0.9359000    
 H   -4.849300      -2.896500      0.3582000    
 H    4.847900      -2.899500     -0.3474000    
 H   -7.126100      0.8340000     -0.7045000    
 H    5.947700       2.224000      0.4442000    
 H   -6.878800      -2.362300     -0.3194000    
 H    7.432400     -0.6375000      0.6230000    


%chk=000004534-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004534

0 1
O -6.516546 1.495243 0.241111
O 6.605271 1.460999 -0.189883
O -7.128101 -1.000277 -0.591350
O 7.106638 -1.055481 0.663617
C -0.746152 0.443161 -0.217706
C 0.740903 0.451611 0.266749
C -1.729869 0.294656 0.987821
C 1.726305 0.310118 -0.938130
C -1.124762 1.656992 -1.098140
C 1.106712 1.671731 1.143839
C -3.148130 -0.078060 0.577188
C 3.149516 -0.044103 -0.529352
C -4.191682 0.882059 0.605182
C 4.188897 0.921837 -0.579032
C -3.446799 -1.396418 0.144834
C 3.468980 -1.350388 -0.075252
C -5.496737 0.537228 0.207075
C 5.494455 0.580714 -0.180542
C -4.755729 -1.753878 -0.255281
C 4.780181 -1.693624 0.323529
C -5.775515 -0.785650 -0.224167
C 5.802283 -0.727175 0.274404
H -0.865750 -0.471063 -0.840404
H 0.870988 -0.458934 0.892375
H -1.325890 -0.483819 1.667211
H -1.746544 1.241614 1.560338
H 1.331603 -0.475996 -1.614198
H 1.728091 1.254765 -1.515876
H -0.474062 1.734921 -1.987706
H -1.045509 2.604456 -0.532556
H -2.167219 1.567517 -1.451949
H 1.020435 2.616708 0.574704
H 0.451967 1.748039 2.030330
H 2.148150 1.589874 1.503085
H -4.004285 1.908044 0.938545
H 3.969242 1.938984 -0.931080
H -2.655120 -2.154279 0.129135
H 2.683556 -2.114648 -0.040809
H -4.974887 -2.778783 -0.581392
H 5.028704 -2.701736 0.668390
H -7.361378 1.071292 -0.064758
H 6.359350 2.359345 -0.515313
H -7.287007 -1.929954 -0.880463
H 7.681245 -0.252541 0.554876


