%chk=000020356.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020356

0 1
 O    3.336600      -1.098500     -0.4520000    
 O   -6.301500      -3.385500      9.4300002E-02
 O    6.140700      -1.750800     -0.4034000    
 O    7.826000     -0.6019000      0.5474000    
 O    8.296800      -2.495900     -0.6616000    
 C   -3.827300       2.175400      0.2266000    
 C   -4.812600       1.247900     -0.4801000    
 C   -2.396300       1.706000      8.3499998E-02
 C   -2.068900      0.3906000     -6.8000001E-03
 C   -4.515000     -0.1945000     -0.1749000    
 C   -3.184100     -0.6050000      4.0100001E-02
 C  -0.6416000     -1.9000000E-03 -0.1245000    
 C   -1.405600       2.803700      6.1400000E-02
 C   -5.555200      -1.134900     -0.1656000    
 C   -2.934200      -1.965700      0.2840000    
 C   -5.286800      -2.479100      7.9800002E-02
 C   -3.978400      -2.893300      0.3066000    
 C  -6.9499999E-02 -0.1416000      -1.382800    
 C   0.1056000     -0.2258000       1.025400    
 C   -1.035200       3.376300      -1.152000    
 C  -0.8500000       3.258000       1.253800    
 C    2.028800     -0.7378000     -0.3442000    
 C    5.605500     -0.5099000      4.2500000E-02
 C    1.271100     -0.5111000      -1.493100    
 C    1.446100     -0.5951000      0.9150000    
 C    4.210300     -0.6967000      0.6022000    
 C    6.612100     -7.4100003E-02   1.065600    
 C  -0.1011000       4.412200      -1.173100    
 C   8.4100001E-02   4.293800       1.232900    
 C   0.4584000       4.870900      1.9400001E-02
 C    7.494900      -1.689600     -0.2146000    
 C   -5.953900      -4.746000      0.3483000    
 H   -4.066900       2.232000       1.296900    
 H   -3.958500       3.185700     -0.1807000    
 H   -4.753300       1.391400      -1.566500    
 H   -5.831000       1.507700     -0.1677000    
 H   -6.578500     -0.8166000     -0.3509000    
 H   -1.926500      -2.332800      0.4609000    
 H   -3.696700      -3.922300      0.5034000    
 H  -0.6487000      3.0999999E-02  -2.286300    
 H  -0.3381000     -0.1253000       2.012700    
 H   -1.463900       3.029700      -2.089000    
 H   -1.133100       2.818600       2.207100    
 H    5.586400      0.1612000     -0.8252000    
 H    1.719700     -0.6206000      -2.476600    
 H    1.992200     -0.7893000       1.833400    
 H    3.895500      0.2563000       1.046100    
 H    4.207000      -1.484100       1.365200    
 H    6.672700       1.014200       1.154100    
 H    6.443800     -0.5064000       2.058000    
 H   0.1905000       4.861500      -2.117900    
 H   0.5199000       4.651000       2.161300    
 H    1.185800       5.677300      3.1000001E-03
 H   -5.525400      -4.871700       1.348500    
 H   -5.303000      -5.148100     -0.4355000    
 H   -6.881700      -5.326900      0.3226000    


%chk=000020356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020356

0 1
O 3.431860 -0.837203 -0.733803
O -6.051190 -3.592017 -0.115243
O 5.881588 -2.509810 -0.016011
O 7.904679 -1.625803 0.676673
O 7.623139 -3.955139 0.611914
C -3.998205 2.087927 0.643668
C -4.896830 1.202980 -0.244187
C -2.517624 1.859079 0.317103
C -2.094855 0.564632 0.055891
C -4.484230 -0.253312 -0.122327
C -3.086966 -0.546151 0.024047
C -0.648116 0.212294 -0.125703
C -1.641907 3.064752 0.299017
C -5.425932 -1.292469 -0.165368
C -2.701753 -1.907091 0.139482
C -5.016079 -2.646390 -0.058367
C -3.644343 -2.957062 0.100623
C -0.197474 -0.478275 -1.286797
C 0.311706 0.534951 0.864924
C -0.666356 3.279861 -0.717400
C -1.813627 4.085172 1.279330
C 2.098248 -0.464833 -0.462041
C 5.769944 -1.036007 -0.239060
C 1.157916 -0.809158 -1.462536
C 1.676249 0.204714 0.711357
C 4.435431 -0.523188 0.278846
C 6.987664 -0.468716 0.538700
C 0.113651 4.454426 -0.740365
C -1.024763 5.255526 1.264474
C -0.054419 5.447686 0.253783
C 7.181033 -2.823140 0.441404
C -5.682486 -5.005011 0.000823
H -4.190764 1.846267 1.711584
H -4.258871 3.150985 0.498796
H -4.788413 1.530125 -1.300153
H -5.960400 1.332083 0.026912
H -6.494071 -1.078936 -0.279004
H -1.644214 -2.155332 0.273391
H -3.302760 -3.991538 0.198705
H -0.920754 -0.750201 -2.063557
H -0.014558 1.055894 1.770996
H -0.535320 2.526815 -1.500719
H -2.560324 3.952707 2.071184
H 5.844652 -0.866880 -1.327102
H 1.506399 -1.333842 -2.357272
H 2.381011 0.470208 1.505359
H 4.494752 0.577374 0.430181
H 4.195271 -1.008242 1.246755
H 7.519991 0.322156 -0.008948
H 6.718971 -0.120367 1.552695
H 0.848051 4.599788 -1.541092
H -1.169777 6.018042 2.038474
H 0.552492 6.359889 0.234387
H -5.201220 -5.216665 0.975467
H -5.006891 -5.313346 -0.820655
H -6.631207 -5.556608 -0.072135


