%chk=000045261.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045261

0 1
 O    1.921100      0.1093000      0.1740000    
 O   -2.867600      0.1659000      0.2743000    
 O   0.8199000     -0.8500000      -1.599000    
 O   -1.850400     -0.8129000      -1.535600    
 C  -0.4681000      0.2016000      0.2028000    
 C  -0.4218000     -0.4559000       1.614900    
 C  -0.5105000       1.746300      0.3890000    
 C   0.8072000     -0.2326000     -0.5409000    
 C   -1.788600     -0.1955000     -0.4776000    
 C    3.171200     -0.3021000     -0.3880000    
 C  -0.5315000      -1.979100       1.614100    
 C  -0.6965000       2.544900     -0.8984000    
 C    4.308400      0.1670000      0.5219000    
 C    3.170400      -1.818000     -0.5326000    
 C    4.307200       1.677700      0.7148000    
 C   -4.145400     -0.2211000     -0.2413000    
 C   -5.224700      0.2545000      0.7077000    
 H   -1.241400     -6.8499997E-02   2.234800    
 H   0.4989000     -0.1761000       2.142200    
 H   0.4192000       2.085400      0.8640000    
 H   -1.317300       2.027700       1.078300    
 H    3.293100      0.1683000      -1.372200    
 H   0.2765000      -2.439800       1.038800    
 H   -1.486300      -2.314200       1.198100    
 H  -0.4675000      -2.356700       2.639900    
 H   9.3400002E-02   2.318800      -1.621100    
 H  -0.6553000       3.617300     -0.6810000    
 H   -1.663700       2.339900      -1.366500    
 H    5.273900     -0.1422000      0.1052000    
 H    4.209300     -0.3008000       1.509100    
 H    4.193200      -2.192400     -0.6546000    
 H    2.625600      -2.171300      -1.411000    
 H    2.734200      -2.303900      0.3470000    
 H    3.391000       2.017900       1.207700    
 H    4.394300       2.194800     -0.2461000    
 H    5.154500       1.977800       1.339600    
 H   -4.186900      -1.312200     -0.3322000    
 H   -4.293400      0.2327000      -1.227500    
 H   -5.183700       1.342500      0.8233000    
 H   -5.078900     -0.1765000       1.703700    
 H   -6.217100     -2.5200000E-02  0.3434000    


%chk=000045261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045261

0 1
O 1.876435 -0.256297 0.279235
O -2.904945 0.316633 0.138232
O 0.659324 -0.170902 -1.704158
O -1.862765 -1.510500 -0.846079
C -0.508454 0.104134 0.476381
C -0.368772 -0.612555 1.869616
C -0.567341 1.653511 0.730293
C 0.692420 -0.157030 -0.454398
C -1.781981 -0.451362 -0.187382
C 3.157267 -0.415931 -0.506017
C -0.229743 -2.147666 1.833601
C -0.707205 2.539884 -0.523647
C 4.257996 0.205624 0.366286
C 3.357143 -1.906523 -0.808681
C 4.094284 1.726305 0.566739
C -4.215141 -0.207909 -0.358509
C -5.285353 0.778124 0.097863
H -1.256011 -0.325846 2.468165
H 0.516547 -0.175826 2.365857
H 0.355607 1.922540 1.280817
H -1.419848 1.839000 1.408157
H 3.028424 0.149128 -1.449435
H 0.686544 -2.448242 1.296168
H -1.087358 -2.632276 1.336169
H -0.162346 -2.542160 2.864084
H 0.131268 2.401116 -1.228334
H -0.731514 3.605134 -0.229354
H -1.643395 2.316924 -1.063954
H 5.230669 -0.010234 -0.118804
H 4.267772 -0.310462 1.345953
H 4.284992 -2.051145 -1.392121
H 2.514996 -2.300177 -1.402132
H 3.440403 -2.488906 0.126473
H 3.125338 1.953097 1.045620
H 4.130160 2.262352 -0.400240
H 4.897059 2.131809 1.208458
H -4.363092 -1.220952 0.058013
H -4.157401 -0.295924 -1.458293
H -5.097888 1.783163 -0.317403
H -5.309660 0.855048 1.198444
H -6.278535 0.438599 -0.248681


