%chk=000087328.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087328

0 1
 O   -1.501300      -2.564800      9.6400000E-02
 O   -2.856100       1.936800     -9.3599997E-02
 O    3.995700      0.3963000      5.3800002E-02
 O   0.5715000      -3.122600      0.9279000    
 O   -1.454300       3.605400      0.6477000    
 O    3.393700       2.237600      -1.189700    
 C   0.1036000     -0.8784000      0.2725000    
 C  -0.5924000       1.433100      0.1755000    
 C    1.720800      0.8509000     -0.2080000    
 C  -0.8994000      8.6099997E-02  0.3681000    
 C    1.413800     -0.4961000     -1.5600000E-02
 C   0.7177000       1.815500     -0.1125000    
 C  -0.2164000      -2.282800      0.4728000    
 C   -1.638000       2.438800      0.2759000    
 C    3.086500       1.249500     -0.5095000    
 C   -1.937200      -3.920000      0.2477000    
 C   -3.969700       2.834800     -3.8400002E-02
 C    5.379700      0.6850000     -0.1714000    
 C   -3.353200      -4.022800     -0.2131000    
 C   -5.196500       2.105100     -0.4754000    
 C    6.204200     -0.3508000      0.5182000    
 C   -3.758300      -4.815000      -1.211900    
 C   -6.279500       1.938400      0.2915000    
 C    7.065000      -1.160100     -0.1090000    
 H   -1.915400     -0.2092000      0.6196000    
 H    2.183800      -1.259200     -0.1034000    
 H   0.9572000       2.866000     -0.2628000    
 H   -1.882700      -4.200800       1.305600    
 H   -1.278600      -4.578300     -0.3308000    
 H   -3.790200       3.675000     -0.7186000    
 H   -4.074300       3.218500      0.9832000    
 H    5.616100       1.669600      0.2476000    
 H    5.575000      0.6998000      -1.250000    
 H   -4.092200      -3.415600      0.3032000    
 H   -5.200500       1.691500      -1.480400    
 H    6.093500     -0.4419000       1.595500    
 H   -4.803800      -4.846100      -1.498600    
 H   -3.061700      -5.441500      -1.758000    
 H   -7.141400       1.398800     -8.5500002E-02
 H   -6.327000       2.332600       1.300500    
 H    7.637100      -1.892300      0.4501000    
 H    7.213800      -1.108700      -1.181800    


%chk=000087328-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087328

0 1
O -1.521318 -2.673948 -0.079330
O -2.954240 1.904855 -0.071406
O 4.111412 0.319983 0.042220
O 0.727576 -3.293028 -0.019954
O -1.460568 3.697720 -0.045896
O 3.526454 2.579198 0.031271
C 0.120046 -0.928272 -0.031732
C -0.610742 1.408587 -0.036596
C 1.781388 0.872242 0.001166
C -0.923787 0.027756 -0.045846
C 1.471872 -0.508172 -0.009176
C 0.739650 1.829662 -0.012983
C -0.152768 -2.398278 -0.041139
C -1.673044 2.460954 -0.051295
C 3.191724 1.369613 0.025932
C -1.891439 -4.128855 -0.091692
C -4.090153 2.885815 -0.094141
C 5.558244 0.720816 0.070099
C -3.349002 -4.221089 0.258859
C -5.318739 2.134366 -0.520967
C 6.346760 -0.486160 0.491422
C -4.264035 -4.878870 -0.494672
C -6.483465 2.139301 0.172637
C 7.394647 -0.982519 -0.210793
H -1.965819 -0.298242 -0.064198
H 2.269305 -1.256384 -0.000926
H 0.979116 2.898163 -0.005931
H -1.244306 -4.644313 0.643407
H -1.673209 -4.535382 -1.095060
H -3.819966 3.693920 -0.800428
H -4.193544 3.323454 0.914543
H 5.657226 1.563492 0.780696
H 5.839682 1.077124 -0.936609
H -3.644245 -3.742142 1.202032
H -5.237610 1.587938 -1.470200
H 6.044771 -0.945609 1.442065
H -5.309957 -4.962415 -0.181073
H -3.992553 -5.357242 -1.443945
H -7.371546 1.615677 -0.196673
H -6.584167 2.671847 1.126503
H 7.972330 -1.839093 0.152108
H 7.706616 -0.544369 -1.166997


