%chk=000021203.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021203

0 1
 O    1.745900       1.117900      -1.975700    
 O   0.3231000       2.996700       1.359100    
 O   -1.513300       2.714800      4.5600001E-02
 C  -0.7311000     -0.1843000      0.1202000    
 C   8.0300003E-02  0.9110000      0.3320000    
 C   -2.178200     -4.8999999E-02  5.9200000E-02
 C  -9.5200002E-02  -1.539300     -2.2700001E-02
 C    1.555000      0.7638000      0.3927000    
 C    2.310200      0.8744000     -0.7585000    
 C    2.131900      0.5168000       1.624200    
 C   -2.936900     -0.1409000       1.226000    
 C   0.2441000      -1.967000      -1.280500    
 C   -2.806900      0.1731000      -1.165800    
 C   0.1145000      -2.280300       1.111600    
 C  -0.4813000       2.284000      0.5340000    
 C    3.695500      0.7324000     -0.6760000    
 C    3.517200      0.3748000       1.706600    
 C   -4.324500     -1.0700000E-02   1.167700    
 C   0.8345000      -3.223700      -1.413200    
 C   -4.194400      0.3036000      -1.224200    
 C   0.7050000      -3.537000      0.9789000    
 C    4.298900      0.4826000      0.5566000    
 C   -4.953300      0.2116000     -5.7300001E-02
 C    1.064900      -4.008700     -0.2836000    
 C    1.594400       2.483200      -2.356900    
 H    1.535100      0.4317000       2.528300    
 H   -2.462900     -0.3119000       2.189600    
 H   6.6600002E-02  -1.363800      -2.165700    
 H   -2.230400      0.2494000      -2.084700    
 H  -0.1632000      -1.921700       2.098100    
 H    4.311100      0.8140000      -1.567800    
 H    3.987000      0.1802000       2.666200    
 H   -4.915400     -8.1600003E-02   2.076300    
 H    1.114600      -3.591000      -2.396200    
 H   -4.684000      0.4774000      -2.177900    
 H   0.8847000      -4.148300       1.858500    
 H    5.377400      0.3718000      0.6207000    
 H   -6.033600      0.3134000     -0.1028000    
 H    1.524700      -4.987200     -0.3868000    
 H    2.543900       2.860000      -2.749200    
 H    1.269300       3.111200      -1.522500    
 H   0.8429000       2.536500      -3.149400    
 H  -2.0400001E-02   3.902300       1.514000    


%chk=000021203-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021203

0 1
O 1.761087 2.199954 -1.595338
O 0.065909 3.182267 0.783307
O -1.516720 2.576305 -0.797320
C -0.794922 -0.255311 0.071232
C 0.017169 0.869275 0.118290
C -2.272952 -0.166563 0.270763
C -0.232520 -1.621979 -0.155719
C 1.493370 0.812467 0.323841
C 2.382057 1.538469 -0.524723
C 2.054584 0.077440 1.395913
C -2.812500 0.603795 1.337383
C 0.765775 -1.839436 -1.146775
C -3.167658 -0.885508 -0.567804
C -0.723440 -2.742910 0.569374
C -0.580390 2.235346 -0.038254
C 3.776568 1.540346 -0.295708
C 3.446437 0.063390 1.631963
C -4.205280 0.674233 1.544238
C 1.267784 -3.133225 -1.391749
C -4.561549 -0.806322 -0.368720
C -0.209479 -4.036382 0.334622
C 4.304816 0.799554 0.786530
C -5.087086 -0.025999 0.688244
C 0.789125 -4.237528 -0.646561
C 2.586489 3.045769 -2.458734
H 1.380037 -0.476352 2.057485
H -2.130434 1.133487 2.013022
H 1.126805 -0.988843 -1.734093
H -2.765094 -1.488637 -1.388986
H -1.503839 -2.594000 1.323813
H 4.451737 2.101447 -0.948676
H 3.853545 -0.508077 2.472369
H -4.602830 1.269246 2.374048
H 2.028921 -3.282995 -2.165656
H -5.238022 -1.350992 -1.036847
H -0.589954 -4.886086 0.912533
H 5.386221 0.801303 0.963705
H -6.170012 0.030556 0.846322
H 1.183518 -5.242533 -0.834661
H 3.348422 2.448134 -2.996157
H 3.083985 3.847800 -1.879895
H 1.884056 3.485981 -3.181427
H -0.326039 4.075308 0.583507


