%chk=000004813.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004813

0 1
 O    4.972400      -1.647400      0.8840000    
 O   -5.187200       1.986700      0.6384000    
 O   -4.269900      -2.538500     -0.5725000    
 O    5.880400      0.7320000     -0.2295000    
 C   -1.994700      0.2968000     -3.6499999E-02
 C    1.810500     -6.8899997E-02 -5.0200000E-02
 C  -0.5921000      0.5908000     -7.3299997E-02
 C   0.3839000     -0.3454000      1.0600000E-02
 C    2.722900     -0.9978000      0.4502000    
 C   -2.465300     -0.9957000     -0.3246000    
 C   -2.929800       1.294700      0.2876000    
 C    2.266200       1.125200     -0.6087000    
 C    4.091100     -0.7325000      0.3919000    
 C   -4.294600       1.008900      0.3223000    
 C   -3.830100      -1.281700     -0.2897000    
 C    3.634400       1.390600     -0.6669000    
 C    4.546800      0.4616000     -0.1667000    
 C   -4.744800     -0.2793000      3.3700000E-02
 H  -0.3449000       1.644700     -0.1600000    
 H   0.1396000      -1.394400      0.1528000    
 H    2.380400      -1.932200      0.8898000    
 H   -1.793900      -1.802800     -0.6064000    
 H   -2.587700       2.302900      0.5157000    
 H    1.597000       1.868400      -1.032000    
 H    3.976700       2.322400      -1.109200    
 H   -5.809900     -0.4953000      6.2500000E-02
 H    5.873300      -1.300600      0.7618000    
 H   -4.703400       2.813200      0.8083000    
 H   -5.239800      -2.556600     -0.5014000    
 H    6.008000       1.601500     -0.6465000    


%chk=000004813-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004813

0 1
O 5.066718 -1.884810 0.010067
O -5.364267 2.060580 -0.061362
O -4.335783 -2.681832 0.166144
O 6.053550 0.627721 -0.129610
C -2.065582 0.242137 -0.016328
C 1.848014 0.016817 -0.045254
C -0.632314 0.577148 -0.053701
C 0.413681 -0.306485 -0.009411
C 2.783485 -1.058943 -0.002395
C -2.549032 -1.091457 0.057584
C -3.007727 1.312690 -0.056947
C 2.351140 1.348119 -0.118694
C 4.165596 -0.817044 -0.032787
C -4.391832 1.042828 -0.022514
C -3.936767 -1.334565 0.091586
C 3.738604 1.597463 -0.149388
C 4.642896 0.518742 -0.106597
C -4.877609 -0.279922 0.052791
H -0.413948 1.652297 -0.123820
H 0.188465 -1.379801 0.060060
H 2.437486 -2.096377 0.054688
H -1.874858 -1.950873 0.087406
H -2.645558 2.347957 -0.114844
H 1.662495 2.197669 -0.151255
H 4.111232 2.628089 -0.205306
H -5.958881 -0.452980 0.078418
H 5.992296 -1.525083 -0.017810
H -4.935360 2.950544 -0.110397
H -5.322034 -2.756573 0.180490
H 6.351395 1.567245 -0.175314


