%chk=000093051.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093051

0 1
 O    1.772100      -3.371100     -0.3053000    
 O    2.590200      -2.282100       1.515800    
 C   -1.768800       1.658300      0.3628000    
 C  -0.3139000       2.086500      0.3987000    
 C    1.887000       2.349000     -0.8956000    
 C   -1.952000      0.1894000      0.7572000    
 C    2.710200       1.185800      -1.466800    
 C   0.4369000       1.995800     -0.7165000    
 C    2.825800     -9.9999997E-05 -0.5305000    
 C   0.1730000       2.596500       1.726900    
 C   -3.405000     -0.1937000      0.7715000    
 C   -4.114600     -0.7523000     -0.2272000    
 C    3.959100      9.8200001E-02  0.4626000    
 C    2.047900      -1.099500     -0.5291000    
 C   -5.571200      -1.113700     -0.1520000    
 C   -3.457600      -1.078100      -1.541700    
 C    2.181000      -2.268900      0.3692000    
 H   -2.177700       1.820600     -0.6438000    
 H   -2.355900       2.309400       1.023800    
 H    2.354900       2.701800      2.6699999E-02
 H    1.937700       3.185300      -1.604100    
 H   -1.364400     -0.4676000      0.1069000    
 H   -1.554100      2.2000000E-02   1.766600    
 H    2.254800      0.8517000      -2.409200    
 H    3.709700       1.544400      -1.741800    
 H  -4.5899998E-02   1.622400      -1.619700    
 H  -0.4217000       3.462800       2.035600    
 H   6.7599997E-02   1.818600       2.490200    
 H    1.218600       2.908400       1.725800    
 H   -3.927600      3.0099999E-02   1.700300    
 H    3.611800      0.5705000       1.387200    
 H    4.774500      0.7108000      6.1799999E-02
 H    4.413200     -0.8687000      0.6967000    
 H    1.259600      -1.174600      -1.275400    
 H   -6.141800     -0.5609000     -0.9050000    
 H   -5.994900     -0.8769000      0.8294000    
 H   -5.707400      -2.186000     -0.3255000    
 H   -2.476000     -0.6212000      -1.684200    
 H   -4.082200     -0.7193000      -2.367700    
 H   -3.347800      -2.162500      -1.646400    
 H    1.841500      -4.182600      0.2415000    


%chk=000093051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093051

0 1
O 0.531705 -2.646345 -0.324672
O 2.426005 -2.420431 0.999465
C -1.657265 1.791296 0.261151
C -0.174560 2.122519 0.389746
C 2.059842 2.625501 -0.819073
C -2.005461 0.344070 0.742662
C 2.830681 1.428069 -1.493057
C 0.571110 2.370130 -0.727018
C 2.864371 0.193475 -0.607841
C 0.379152 2.119205 1.804833
C -3.468344 0.016881 0.527968
C -4.005357 -1.008475 -0.196167
C 3.967257 0.145450 0.426232
C 1.888997 -0.761094 -0.758061
C -5.514359 -1.167337 -0.314819
C -3.200570 -2.066351 -0.932433
C 1.714079 -1.965921 0.064721
H -1.978695 1.896652 -0.792177
H -2.261472 2.508180 0.857359
H 2.501295 2.829498 0.173378
H 2.248537 3.522282 -1.442843
H -1.349933 -0.375570 0.220778
H -1.766520 0.264080 1.823770
H 2.340361 1.201737 -2.458184
H 3.864573 1.761806 -1.709540
H 0.051183 2.339897 -1.698453
H -0.297697 2.670241 2.486228
H 0.459488 1.087622 2.199975
H 1.379046 2.577799 1.876558
H -4.170755 0.714541 1.014287
H 4.040991 1.115853 0.954538
H 4.942439 -0.007883 -0.078483
H 3.825871 -0.665288 1.155096
H 1.130530 -0.633115 -1.537340
H -5.834512 -1.136068 -1.375839
H -6.055679 -0.374331 0.230301
H -5.844713 -2.147062 0.085165
H -2.110735 -1.948890 -0.822355
H -3.438671 -2.050997 -2.015253
H -3.471694 -3.078265 -0.568877
H 0.436079 -3.454861 0.247973


