%chk=000016317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016317

0 1
 O   0.3573000       2.575100     -0.7306000    
 O   -1.973600       2.782100      0.5861000    
 C  -0.3053000     -0.8732000     -2.6200000E-02
 C   0.5355000      0.2677000     -8.2500003E-02
 C   -1.789800     -0.7519000     -4.9800001E-02
 C    1.966800      0.1767000     -2.3200000E-02
 C   -2.410500      0.4997000      0.1065000    
 C    2.542700      -1.113700      5.7900000E-02
 C  -0.1434000       1.580600     -0.2323000    
 C   0.3298000      -2.120700      7.1999997E-02
 C   -1.568900       1.696800      0.2038000    
 C    1.719500      -2.239900      0.1010000    
 C   -2.651500      -1.856000     -0.2019000    
 C    2.871800       1.271600     -1.4400000E-02
 C   -3.803000      0.6507000      0.1494000    
 C    3.938000      -1.279000      0.1083000    
 C   -4.044700      -1.716100     -0.1706000    
 C    4.257700       1.095500      3.9200000E-02
 C   -4.619800     -0.4646000      1.2200000E-02
 C    4.791600     -0.1815000      9.4999999E-02
 H  -0.2365000      -3.045700      0.1378000    
 H    2.149100      -3.237800      0.1732000    
 H   -2.267100      -2.860900     -0.3532000    
 H    2.519900       2.298200     -3.1800002E-02
 H   -4.260900       1.628200      0.2739000    
 H    4.375200      -2.274400      0.1651000    
 H   -4.677300      -2.591500     -0.2883000    
 H    4.913900       1.961000      4.2199999E-02
 H   -5.700000     -0.3579000      3.7799999E-02
 H    5.866800     -0.3247000      0.1376000    


%chk=000016317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016317

0 1
O 0.507935 2.762657 -0.285395
O -2.155201 2.908262 0.373398
C -0.304442 -0.828896 0.001570
C 0.531834 0.328861 -0.030816
C -1.792614 -0.734779 -0.031435
C 1.985495 0.186136 -0.010297
C -2.442367 0.532185 0.073250
C 2.558495 -1.146118 0.054433
C -0.106632 1.674753 -0.075163
C 0.306232 -2.123887 0.064506
C -1.640543 1.776610 0.151599
C 1.687005 -2.277814 0.091851
C -2.622607 -1.884122 -0.146134
C 2.903011 1.292274 -0.037975
C -3.856025 0.635602 0.088238
C 3.978801 -1.329655 0.087500
C -4.029128 -1.778099 -0.142690
C 4.286699 1.083581 -0.001387
C -4.656929 -0.515637 -0.018091
C 4.838352 -0.231723 0.059631
H -0.317107 -3.019284 0.108351
H 2.125943 -3.281115 0.146301
H -2.185293 -2.879914 -0.251892
H 2.504755 2.304773 -0.100806
H -4.294497 1.634690 0.178333
H 4.375445 -2.350516 0.136908
H -4.636752 -2.684516 -0.238855
H 4.957989 1.949268 -0.022597
H -5.748715 -0.437110 -0.013047
H 5.924161 -0.372067 0.084910


