%chk=000089745.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089745

0 1
 O    5.971800     -5.5000000E-02 -0.5102000    
 O   -5.975400      7.2899997E-02  0.4924000    
 O    5.072800     -0.7533000      0.4004000    
 O   -5.059100      0.7759000     -0.3973000    
 O    4.826800      -2.123500      -1.445700    
 O   -4.811100       2.109600       1.475300    
 C   0.4680000     -0.3119000      0.5605000    
 C  -0.4606000      0.2543000     -0.5180000    
 C    1.586400      -1.193800     -1.0000000E-03
 C   -1.594000       1.113300      4.6799999E-02
 C    2.474100      -1.743200       1.120500    
 C   -2.451700       1.709800      -1.073900    
 C    3.621500      -2.598900      0.5900000    
 C   -3.572200       2.596300     -0.5390000    
 C    6.105700       1.254100      2.5300000E-02
 C   -6.132100      -1.220300     -7.5099997E-02
 C    4.568000      -1.818800     -0.2885000    
 C   -4.536900       1.814900      0.3188000    
 C    4.726100       1.910100      5.7599999E-02
 C    7.048800       2.031600     -0.8903000    
 C    6.690700       1.146100       1.432800    
 C   -6.723300      -1.068500      -1.475800    
 C   -7.081800      -2.006200      0.8264000    
 C   -4.762500      -1.895500     -0.1318000    
 H   0.9105000      0.5194000       1.123400    
 H  -0.1278000     -0.8955000       1.273300    
 H  -0.8900000     -0.5746000      -1.094300    
 H   0.1343000      0.8529000      -1.219100    
 H    1.150700      -2.026200     -0.5664000    
 H    2.184000     -0.6020000     -0.7039000    
 H   -2.209300      0.4966000      0.7120000    
 H   -1.171400       1.922700      0.6542000    
 H    2.868200     -0.9116000       1.717100    
 H    1.864700      -2.354900       1.796600    
 H   -2.863100      0.9020000      -1.690900    
 H   -1.815800       2.314400      -1.732200    
 H    3.224900      -3.439000      8.2000000E-03
 H    4.198900      -3.024700       1.418000    
 H   -3.154700       3.411600      6.2600002E-02
 H   -4.134200       3.051900      -1.361400    
 H    4.247600       1.859300     -0.9273000    
 H    4.044700       1.419800      0.7616000    
 H    4.796200       2.963000      0.3522000    
 H    6.655000       2.070300      -1.912500    
 H    8.025300       1.537700     -0.9537000    
 H    7.201400       3.057200     -0.5387000    
 H    6.006800      0.6566000       2.135000    
 H    7.612200      0.5527000       1.426900    
 H    6.921900       2.136100       1.840800    
 H   -7.637900     -0.4651000      -1.449000    
 H   -6.037600     -0.5673000      -2.167900    
 H   -6.967800      -2.044600      -1.908900    
 H   -8.050200      -1.499300      0.9081000    
 H   -6.682800      -2.076800       1.844800    
 H   -7.252200      -3.020100      0.4500000    
 H   -4.079400      -1.401400     -0.8314000    
 H   -4.275800      -1.872400      0.8501000    
 H   -4.850700      -2.940700     -0.4477000    


%chk=000089745-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089745

0 1
O 6.548105 1.009688 -0.492380
O -6.555078 -0.999577 0.485311
O 5.755846 0.263176 0.588959
O -5.753715 -0.263954 -0.596783
O 4.565769 2.285856 0.921848
O -4.588280 -2.301289 -0.927182
C 0.314217 0.222821 0.660706
C -0.314925 -0.266571 -0.663086
C 1.836903 -0.025893 0.737127
C -1.836566 -0.012023 -0.741477
C 2.453121 0.469767 2.064089
C -2.453755 -0.507257 -2.068123
C 3.978149 0.220236 2.166746
C -3.976349 -0.244678 -2.175235
C 7.982547 1.145476 -0.036416
C -7.991395 -1.116053 0.029882
C 4.754645 1.085962 1.175629
C -4.762849 -1.099570 -1.182610
C 8.053293 1.977096 1.257513
C 8.556887 1.913931 -1.247280
C 8.614585 -0.249962 0.120306
C -8.605178 0.287798 -0.124702
C -8.575226 -1.878666 1.239914
C -8.073551 -1.944874 -1.265189
H 0.115584 1.308057 0.781862
H -0.186595 -0.283445 1.512418
H -0.119936 -1.352616 -0.782731
H 0.188533 0.236980 -1.514870
H 2.040280 -1.110332 0.616174
H 2.331892 0.485368 -0.113358
H -2.334720 -0.519289 0.109559
H -2.035237 1.073557 -0.622869
H 2.262742 1.554134 2.178910
H 1.959491 -0.040528 2.914679
H -2.272334 -1.593561 -2.179056
H -1.953807 -0.003968 -2.919224
H 4.222553 -0.844241 2.005452
H 4.335318 0.494340 3.179220
H -4.211171 0.822599 -2.018392
H -4.333748 -0.519607 -3.187367
H 7.483906 2.914808 1.142332
H 7.636113 1.414054 2.110950
H 9.104273 2.223077 1.494867
H 8.080101 2.903633 -1.345840
H 8.396318 1.348226 -2.181089
H 9.643262 2.054752 -1.104905
H 8.088837 -0.826827 0.900133
H 8.554550 -0.811328 -0.828055
H 9.677189 -0.158422 0.410845
H -8.540826 0.845824 0.825347
H -8.069714 0.859976 -0.901355
H -9.667929 0.210533 -0.418757
H -8.402451 -1.318753 2.175044
H -8.115023 -2.876612 1.334007
H -9.664251 -2.000393 1.100224
H -7.653383 -1.384625 -2.118987
H -7.512975 -2.888247 -1.152941
H -9.127442 -2.180566 -1.499998


