%chk=000081005.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081005

0 1
 O   -2.760200      0.4398000     -0.1942000    
 O    3.477500      0.2414000     -5.4400001E-02
 O    1.761900       2.412900     -0.1663000    
 O    2.447800      -2.301000      0.3321000    
 O   -2.573400      -1.409700       1.163700    
 C   -4.187900      0.3557000     -0.1284000    
 C  -0.6185000     -0.3114000      0.3531000    
 C    2.132900      5.9599999E-02  7.9800002E-02
 C    1.272300       1.155800      2.2800000E-02
 C    1.617900      -1.222100      0.2734000    
 C  -0.1034000      0.9703000      0.1596000    
 C   0.2422000      -1.407700      0.4101000    
 C   -2.052400     -0.5050000      0.4977000    
 C   -4.794100       1.500200     -0.9260000    
 C   -4.634500      -1.000200     -0.6536000    
 C    3.933100      0.8247000      -1.273000    
 C    2.100200       3.159000       1.001200    
 C    2.738500      -2.962400     -0.8976000    
 H   -4.498800      0.4709000      0.9175000    
 H  -0.7547000       1.840400      0.1233000    
 H  -0.1501000      -2.411000      0.5590000    
 H   -4.490600       1.446100      -1.977300    
 H   -5.887000       1.490000     -0.8743000    
 H   -4.434900       2.462100     -0.5447000    
 H   -5.700300     -0.9830000     -0.9080000    
 H   -4.519600      -1.804300      7.6899998E-02
 H   -4.073900      -1.285500      -1.550600    
 H    4.083700       1.899700      -1.141100    
 H    3.247000      0.6347000      -2.105900    
 H    4.899800      0.3758000      -1.519700    
 H    2.874200       2.643200       1.578300    
 H    1.213500       3.321300       1.622300    
 H    2.489100       4.130900      0.6856000    
 H    3.230200      -2.279600      -1.597400    
 H    1.822200      -3.361900      -1.343700    
 H    3.416200      -3.794200     -0.6871000    


%chk=000081005-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081005

0 1
O -3.014938 0.375887 -0.095540
O 3.413602 0.158966 -0.183035
O 1.583856 2.306955 -0.628984
O 2.257538 -2.509412 0.473197
O -2.745647 -1.883961 0.431227
C -4.512231 0.206658 -0.047748
C -0.783275 -0.480417 0.057446
C 2.019959 -0.068287 -0.132200
C 1.100438 1.008912 -0.324755
C 1.509885 -1.362232 0.192853
C -0.286476 0.811850 -0.249936
C 0.110282 -1.548059 0.287706
C -2.245200 -0.763418 0.154510
C -5.063810 1.596955 0.275563
C -4.990329 -0.359917 -1.392568
C 3.933067 0.597487 -1.502820
C 2.266466 2.977884 0.502891
C 3.659903 -2.645776 0.043591
H -4.729439 -0.514019 0.762725
H -0.963976 1.651623 -0.415592
H -0.277223 -2.541798 0.529047
H -4.798576 2.316769 -0.518916
H -6.165325 1.554977 0.354548
H -4.658882 1.967881 1.232630
H -6.091530 -0.457804 -1.388994
H -4.556494 -1.357636 -1.572137
H -4.703137 0.312914 -2.220076
H 3.404965 1.504055 -1.844448
H 3.813145 -0.215374 -2.244890
H 5.001715 0.805816 -1.341450
H 3.135102 2.386286 0.844836
H 1.557536 3.126078 1.339310
H 2.593927 3.953254 0.111862
H 4.318306 -1.955405 0.593180
H 3.763001 -2.469026 -1.043895
H 3.909696 -3.693165 0.273962


