%chk=000106215.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106215

0 1
 O    2.772000      0.3671000      0.5043000    
 O    2.547400      -1.911000      0.2618000    
 C   -3.565800      0.3161000     -0.1048000    
 C   -2.060800      2.2399999E-02  1.0900000E-02
 C   -4.326200     -0.4173000       1.021200    
 C   -4.087400     -0.1746000      -1.472800    
 C   -3.920300       1.816200      7.1999999E-03
 C   -1.643100      -1.282000     -7.7000000E-02
 C   -1.203400       1.078000      0.1959000    
 C   0.6245000     -0.5020000      0.2155000    
 C  -0.2779000      -1.548600      2.7200000E-02
 C   0.1618000      0.8113000      0.2999000    
 C    4.106900      0.3773000     -1.2900000E-02
 C    2.047900     -0.7798000      0.3245000    
 C    4.065600      0.1134000      -1.510400    
 C    4.758800       1.713300      0.3094000    
 H   -5.398000     -0.1892000      0.9867000    
 H   -4.231000      -1.506300      0.9498000    
 H   -3.954200     -0.1182000       2.008400    
 H   -3.987800      -1.258700      -1.594100    
 H   -5.150500      6.2600002E-02  -1.597600    
 H   -3.541600      0.3005000      -2.296800    
 H   -5.003500       1.967200     -8.2000002E-02
 H   -3.625500       2.236700      0.9759000    
 H   -3.456100       2.408500     -0.7902000    
 H   -2.326400      -2.111500     -0.2234000    
 H   -1.507300       2.114300      0.2680000    
 H   6.1700001E-02  -2.578700     -4.1299999E-02
 H   0.8283000       1.657000      0.4458000    
 H    4.683100     -0.4109000      0.4873000    
 H    5.061800      0.2181000      -1.952700    
 H    3.709400     -0.8938000      -1.745800    
 H    3.388900      0.8145000      -2.011900    
 H    5.790500       1.752500     -5.2600000E-02
 H    4.760300       1.885100       1.391200    
 H    4.196500       2.540000     -0.1388000    


%chk=000106215-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000106215

0 1
O 2.807375 0.496723 -0.053854
O 2.533598 -1.822839 -0.134852
C -3.784264 0.312481 -0.023218
C -2.252958 0.098854 -0.038040
C -4.388844 -0.383069 1.234759
C -4.402362 -0.319817 -1.307914
C -4.173912 1.812384 0.016105
C -1.723523 -1.223252 -0.071018
C -1.327640 1.175613 -0.022662
C 0.573234 -0.371632 -0.072736
C -0.338198 -1.459717 -0.088582
C 0.065016 0.949757 -0.039350
C 4.303930 0.318415 -0.084164
C 2.033549 -0.668173 -0.093578
C 4.752909 0.147652 -1.542708
C 4.871665 1.562995 0.601477
H -5.486459 -0.246461 1.252364
H -4.182263 -1.468080 1.242215
H -3.970881 0.047851 2.162881
H -4.190175 -1.401669 -1.374939
H -5.500704 -0.188471 -1.304464
H -3.998439 0.161749 -2.217192
H -5.275179 1.906847 0.024922
H -3.788412 2.313470 0.923351
H -3.798928 2.357796 -0.869678
H -2.404923 -2.081453 -0.083524
H -1.690174 2.207023 0.002407
H 0.063187 -2.478346 -0.114777
H 0.765990 1.789252 -0.026617
H 4.530963 -0.599520 0.489533
H 5.852713 0.043363 -1.589228
H 4.303293 -0.756232 -1.986575
H 4.461296 1.027554 -2.143471
H 5.974025 1.498063 0.644676
H 4.486009 1.654592 1.631245
H 4.598087 2.475799 0.043005


