%chk=000016588.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016588

0 1
 O    4.377500     -0.6398000     -0.2802000    
 O    3.365700       1.309500      0.4246000    
 C   -3.028400     -0.6504000      4.3800000E-02
 C   -1.751800      0.1700000      0.2525000    
 C   -4.320300      0.1553000      0.2741000    
 C  -0.5033000     -0.6597000     -5.9500001E-02
 C   0.7751000      0.1498000      0.1795000    
 C   -4.343700       1.373800     -0.6520000    
 C   -5.579800     -0.6838000      5.4000001E-02
 C    2.040200     -0.6624000     -9.6799999E-02
 C    3.311500      0.1412000      6.6000000E-02
 C    5.657400     -3.5999999E-03 -0.2059000    
 H   -3.018500      -1.510100      0.7256000    
 H   -3.033100      -1.060300     -0.9747000    
 H   -1.739300       1.047000     -0.4022000    
 H   -1.713600      0.5315000       1.286800    
 H   -4.331800      0.5120000       1.311800    
 H  -0.5343000     -0.9978000      -1.102300    
 H  -0.4905000      -1.556100      0.5722000    
 H   0.7953000      0.5103000       1.215700    
 H   0.7665000       1.041500     -0.4600000    
 H   -3.598900       2.120300     -0.3611000    
 H   -4.166400       1.090200      -1.695000    
 H   -5.317200       1.874900     -0.6045000    
 H   -6.481900     -9.8300003E-02  0.2606000    
 H   -5.638300      -1.047600     -0.9774000    
 H   -5.584500      -1.552900      0.7201000    
 H    2.086700      -1.514900      0.5903000    
 H    2.010100      -1.039000      -1.125800    
 H    6.416500     -0.7310000     -0.5057000    
 H    5.862700      0.3153000      0.8204000    
 H    5.697200      0.8484000     -0.8913000    


%chk=000016588-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016588

0 1
O 4.469997 -0.729705 0.017579
O 3.489957 1.376432 -0.143807
C -3.055963 -0.581571 -0.102103
C -1.751518 0.207984 0.150669
C -4.358211 0.162596 0.299367
C -0.480602 -0.615769 -0.157462
C 0.823055 0.177195 0.078605
C -4.579834 1.445517 -0.538701
C -5.579450 -0.779616 0.175059
C 2.080624 -0.666019 -0.214051
C 3.370348 0.130702 -0.109035
C 5.796224 -0.068617 0.081344
H -3.007452 -1.537345 0.461442
H -3.118147 -0.856977 -1.176886
H -1.740199 1.129053 -0.465753
H -1.724614 0.540082 1.209963
H -4.260616 0.461107 1.365754
H -0.516616 -0.960529 -1.212634
H -0.479100 -1.532734 0.468952
H 0.856469 0.537011 1.125818
H 0.837207 1.082466 -0.557334
H -3.763514 2.177240 -0.401435
H -4.637339 1.198169 -1.616958
H -5.526541 1.942828 -0.256170
H -6.510450 -0.274338 0.493327
H -5.715145 -1.105789 -0.874615
H -5.453303 -1.685957 0.796753
H 2.151014 -1.541267 0.457594
H 2.029637 -1.077463 -1.243408
H 6.516248 -0.892798 0.181574
H 5.844389 0.610408 0.949259
H 5.980244 0.511003 -0.839107


