%chk=000007658.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007658

0 1
 O  -0.9013000     -0.6995000      0.4364000    
 O   -2.609700      -1.564000     -0.8507000    
 C    1.244600      -1.732600      0.8575000    
 C  -0.1043000      -1.855200      0.1572000    
 C    2.035200     -0.5405000      0.3756000    
 C   -2.847900      0.5906000      0.2523000    
 C   -4.236600      0.6896000     -0.3740000    
 C   -2.141100     -0.6877000     -0.1371000    
 C    2.898000     -0.6868000     -0.6992000    
 C    1.883900      0.6793000       1.016200    
 C   -4.950100       1.962800      5.0400000E-02
 C    3.628400      0.4147000      -1.144800    
 C    2.614400       1.780900      0.5704000    
 C    3.486600       1.648500     -0.5100000    
 H    1.091300      -1.641600       1.940500    
 H    1.826600      -2.649900      0.7057000    
 H  -0.6238000      -2.746900      0.5269000    
 H   3.4100000E-02  -1.946000     -0.9270000    
 H   -2.931500      0.6136000       1.344700    
 H   -2.233400       1.436100     -7.6800004E-02
 H   -4.156000      0.6652000      -1.467400    
 H   -4.841900     -0.1771000     -8.2300000E-02
 H    3.013400      -1.643100      -1.201200    
 H    1.207800      0.7936000       1.858700    
 H   -5.941400       2.013600     -0.4106000    
 H   -5.078600       1.997100       1.136900    
 H   -4.386500       2.849300     -0.2575000    
 H    4.307100      0.3120000      -1.986400    
 H    2.504000       2.741800       1.064500    
 H    4.055200       2.506300     -0.8571000    


%chk=000007658-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007658

0 1
O -0.977306 -0.721592 0.430335
O -2.535047 -1.355722 -1.181904
C 1.212344 -1.742818 0.788824
C -0.104586 -1.855728 0.004092
C 2.090782 -0.574243 0.360694
C -2.933529 0.655339 0.213377
C -4.422604 0.647443 -0.191582
C -2.179469 -0.571554 -0.272526
C 3.205277 -0.784982 -0.491204
C 1.804811 0.748885 0.787951
C -5.139678 1.950122 0.218723
C 4.013530 0.296573 -0.911272
C 2.610683 1.831883 0.371271
C 3.718179 1.610155 -0.480684
H 0.965307 -1.673492 1.865022
H 1.759152 -2.694325 0.643243
H -0.634465 -2.799032 0.232076
H 0.050804 -1.794386 -1.087769
H -2.811490 0.737647 1.309234
H -2.429299 1.545521 -0.216407
H -4.497307 0.494996 -1.283819
H -4.923370 -0.222721 0.274256
H 3.445021 -1.802728 -0.824928
H 0.943050 0.923746 1.441303
H -6.204422 1.925495 -0.075633
H -5.096893 2.107486 1.313122
H -4.677007 2.830732 -0.265991
H 4.872169 0.114087 -1.567551
H 2.377281 2.847342 0.711657
H 4.344583 2.449967 -0.802109