%chk=000006291.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006291

0 1
 O   -4.905700      0.9012000      -1.125000    
 O    5.991300     -6.8300001E-02 -0.1179000    
 C   -2.532700      0.4318000     -0.5894000    
 C   -1.905800     -0.7710000      0.1517000    
 C  -0.4064000     -0.9117000     -0.1214000    
 C   -4.034300      0.2399000     -0.2179000    
 C   0.3199000      0.3749000      0.3741000    
 C   -1.843700       1.713700     -8.8399999E-02
 C   -2.829700      -1.931900     -0.2077000    
 C  -0.3116000       1.649300     -0.2460000    
 C   -4.228300      -1.293900     -0.3393000    
 C   0.2044000      -2.127700      0.5789000    
 C   -2.371100      0.3661000      -2.137300    
 C    1.832600      0.2564000      0.2064000    
 C    1.658300      -2.296700      0.1488000    
 C    2.450200      -1.012000      0.1435000    
 C   -4.370800      0.6793000       1.150700    
 C    2.655700       1.396600      0.1998000    
 C    3.847900      -1.105700      2.2200000E-02
 C    4.043800       1.288900      8.9000002E-02
 C    4.639900      3.8300000E-02 -5.4000001E-03
 C   -4.644500       1.036200       2.263700    
 C    6.740400       1.146400     -0.1330000    
 H   -2.010800     -0.6176000       1.237600    
 H  -0.2400000      -1.036900      -1.199000    
 H   0.1600000      0.4487000       1.461100    
 H   -2.052400       1.878400      0.9750000    
 H   -2.231800       2.591900     -0.6184000    
 H   -2.822100      -2.709400      0.5631000    
 H   -2.536200      -2.401900      -1.153100    
 H  -3.6800001E-02   1.724800      -1.304700    
 H   9.5200002E-02   2.546000      0.2360000    
 H   -4.667200      -1.568600      -1.306400    
 H   -4.902500      -1.690500      0.4295000    
 H  -0.3442000      -3.044400      0.3357000    
 H   0.1488000      -2.002000       1.668000    
 H   -1.326600      0.3427000      -2.457600    
 H   -2.853300     -0.5146000      -2.572800    
 H   -2.823500       1.247000      -2.607800    
 H    1.684300      -2.711500     -0.8671000    
 H    2.137400      -3.025600      0.8137000    
 H   -5.814000      0.6027000     -0.9452000    
 H    2.234500       2.393500      0.2891000    
 H    4.320200      -2.083500     -4.8799999E-02
 H    4.595700       2.222900      8.6599998E-02
 H   -4.886300       1.352700       3.251300    
 H    6.636300       1.694600      0.8094000    
 H    6.488300       1.763700      -1.002000    
 H    7.796400      0.8738000     -0.2298000    


%chk=000006291-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006291

0 1
O -4.916992 1.001253 -1.138313
O 6.062294 -0.081217 -0.069726
C -2.552012 0.416315 -0.604781
C -1.921410 -0.800109 0.142064
C -0.412059 -0.932141 -0.123612
C -4.064396 0.224045 -0.206370
C 0.296015 0.372531 0.361098
C -1.870219 1.713746 -0.115003
C -2.861780 -1.988753 -0.196985
C -0.327701 1.643511 -0.287019
C -4.274372 -1.332885 -0.362453
C 0.230962 -2.146915 0.578973
C -2.443177 0.310883 -2.150011
C 1.823200 0.275676 0.204256
C 1.696681 -2.307002 0.128883
C 2.478987 -0.994039 0.136274
C -4.364150 0.649328 1.179538
C 2.632415 1.437501 0.177057
C 3.886198 -1.053680 0.046703
C 4.040839 1.384480 0.084335
C 4.671976 0.119994 0.019456
C -4.693710 0.985632 2.319999
C 6.910227 1.110918 -0.096700
H -2.035175 -0.594405 1.230640
H -0.242592 -1.048542 -1.216031
H 0.080768 0.440052 1.454314
H -2.106066 1.866557 0.957150
H -2.268599 2.589953 -0.661961
H -2.853183 -2.754274 0.598202
H -2.543973 -2.485149 -1.133662
H -0.049873 1.678825 -1.358799
H 0.104777 2.551628 0.173940
H -4.685664 -1.511301 -1.372153
H -5.000399 -1.719486 0.373511
H -0.329482 -3.072894 0.347816
H 0.179721 -2.001090 1.677860
H -1.396136 0.406538 -2.481721
H -2.830855 -0.646433 -2.539406
H -3.030551 1.119222 -2.615451
H 1.709530 -2.717320 -0.902830
H 2.218535 -3.051661 0.760394
H -5.837598 1.026681 -0.771749
H 2.160849 2.424267 0.230926
H 4.398802 -2.021245 -0.002832
H 4.617672 2.314110 0.066677
H -4.962534 1.287060 3.315661
H 6.795340 1.710075 0.828093
H 6.687665 1.745840 -0.976936
H 7.940403 0.730920 -0.165817


