%chk=000006911.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006911

0 1
 O   -2.472600      0.1744000      0.2581000    
 O    3.721900     -0.2373000      0.5899000    
 C  -0.9949000       2.593700      4.2199999E-02
 C   -1.327700      -2.418000      3.1099999E-02
 C  -0.3412000       1.196600     -8.6499996E-02
 C  -0.5242000      -1.164800     -8.7200001E-02
 C   -1.130400      8.5900001E-02  3.1399999E-02
 C    1.008300       1.155200     -0.3137000    
 C   0.8483000      -1.255500     -0.3187000    
 C   -2.085500       2.858200      -1.019000    
 C   -1.663000       2.734400       1.427300    
 C   7.8199998E-02   3.691700     -0.1232000    
 C  -0.4791000      -3.597000      0.6095000    
 C   -1.887100      -2.879800      -1.354000    
 C   -2.581300      -2.319300      0.9659000    
 C    1.614700     -9.5500000E-02 -0.4320000    
 C    3.082100     -0.1923000     -0.6796000    
 C    5.133600     -0.3307000      0.4585000    
 H    1.661400       2.011300     -0.4102000    
 H    1.354800      -2.206700     -0.4397000    
 H   -2.962500       2.214500     -0.9099000    
 H   -1.689900       2.699900      -2.029200    
 H   -2.447400       3.891900     -0.9630000    
 H   -2.555900       2.117200       1.555800    
 H   -1.980500       3.770600       1.597600    
 H  -0.9620000       2.474900       2.229600    
 H  -0.3833000       4.683400     -2.2900000E-02
 H   0.8482000       3.651000      0.6568000    
 H   0.5454000       3.682900      -1.115400    
 H   -1.106000      -4.473700      0.8138000    
 H   0.2875000      -3.945400     -9.0899996E-02
 H   6.0000001E-03  -3.314700       1.551300    
 H   -1.070200      -3.063000      -2.061900    
 H   -2.465800      -3.805800      -1.261800    
 H   -2.536200      -2.115500      -1.795700    
 H   -2.933800      -3.320700       1.245900    
 H   -2.347000      -1.799500       1.902000    
 H   -3.450600      -1.855700      0.4906000    
 H    3.319700      -1.095300      -1.255500    
 H    3.437900      0.6725000      -1.253000    
 H   -2.909600     -0.1523000     -0.5482000    
 H    5.409600      -1.247300     -7.1900003E-02
 H    5.571300     -0.3619000       1.459900    
 H    5.528400      0.5435000     -6.8300001E-02


%chk=000006911-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006911

0 1
O -2.548356 0.252090 -0.028327
O 3.700301 -1.222966 0.193573
C -1.172453 2.768575 -0.213254
C -1.240831 -2.443165 0.153736
C -0.431532 1.407891 -0.131073
C -0.465024 -1.097312 0.049797
C -1.132176 0.164809 -0.035277
C 0.980755 1.341973 -0.140211
C 0.951992 -1.083084 0.033426
C -2.077550 2.811123 -1.482959
C -2.039306 2.983773 1.065594
C -0.183961 3.963053 -0.307836
C -0.274596 -3.657518 0.237027
C -2.120828 -2.677868 -1.118146
C -2.107118 -2.491947 1.456344
C 1.679914 0.117131 -0.061656
C 3.199056 0.120303 -0.097654
C 5.156536 -1.287072 0.143108
H 1.554298 2.271927 -0.208106
H 1.520304 -2.011079 0.102450
H -2.827922 2.006022 -1.462711
H -1.467350 2.701694 -2.399146
H -2.604095 3.783458 -1.534801
H -2.794538 2.190066 1.171881
H -2.558821 3.959362 1.005455
H -1.403431 2.988460 1.970708
H -0.763563 4.902673 -0.364703
H 0.472418 4.029383 0.579956
H 0.449625 3.907320 -1.212781
H -0.866202 -4.589150 0.306446
H 0.367383 -3.731184 -0.658748
H 0.376677 -3.603785 1.127569
H -1.477782 -2.724512 -2.015301
H -2.662441 -3.638269 -1.030263
H -2.872314 -1.889700 -1.310578
H -2.634635 -3.461821 1.522120
H -1.456627 -2.389650 2.343382
H -2.872615 -1.696563 1.535250
H 3.563258 0.442561 -1.101847
H 3.601402 0.844724 0.647806
H -2.943255 -0.645868 0.073358
H 5.543346 -1.020548 -0.864404
H 5.429806 -2.328641 0.374299
H 5.621850 -0.610667 0.892299


