%chk=000091227.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091227

0 1
 Br  -5.131700      -2.273400      1.1600000E-02
 Br  -6.184500       2.191500     -0.4031000    
 O    7.863200     -2.4800001E-02 -0.3439000    
 C   0.3124000     -0.2779000     -0.3299000    
 C    1.602600      0.1478000      0.3794000    
 C  -0.9555000      0.1835000      0.3930000    
 C    2.905700     -0.2713000     -0.3113000    
 C   -2.246300     -0.3110000     -0.2687000    
 C    4.159300      0.2589000      0.3894000    
 C   -3.554400      8.4200002E-02  0.4354000    
 C    5.455100     -0.1134000     -0.3320000    
 C   -4.849800     -0.3440000     -0.2705000    
 C    6.708300      0.3856000      0.3774000    
 C   -6.084500      0.3644000      0.2731000    
 H   0.3021000      -1.371100     -0.4191000    
 H   0.3120000      0.1235000      -1.350600    
 H    1.596600       1.240400      0.4828000    
 H    1.598700     -0.2594000       1.398300    
 H  -0.9301000     -0.1756000       1.429200    
 H  -0.9699000       1.279200      0.4379000    
 H    2.892200      9.3599997E-02  -1.345700    
 H    2.950300      -1.365900     -0.3618000    
 H   -2.276400      6.8800002E-02  -1.297900    
 H   -2.198700      -1.403800     -0.3449000    
 H    4.189600     -0.1318000       1.414000    
 H    4.095400       1.351100      0.4683000    
 H   -3.540300       1.176800      0.5295000    
 H   -3.535600     -0.3046000       1.461900    
 H    5.518000      -1.203600     -0.4417000    
 H    5.439900      0.2841000      -1.354700    
 H   -4.765400     -0.2225000      -1.355700    
 H    6.768800     -2.6300000E-02   1.389800    
 H    6.707500       1.478500      0.4394000    
 H   -7.016000     -0.1061000     -5.7100002E-02
 H   -6.088900      0.4274000       1.365600    
 H    8.636100      0.3126000      0.1401000    


%chk=000091227-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091227

0 1
Br -5.092539 -2.345241 -0.051516
Br -6.237543 2.279930 -0.204539
O 7.887083 -0.103320 -0.434619
C 0.322147 -0.287064 -0.279052
C 1.601523 0.218805 0.424572
C -0.979141 0.163987 0.421072
C 2.900367 -0.209962 -0.294007
C -2.253526 -0.350080 -0.285655
C 4.182302 0.290552 0.409188
C -3.546268 0.142041 0.398249
C 5.472863 -0.132265 -0.328153
C -4.839920 -0.299098 -0.292678
C 6.742061 0.362143 0.370006
C -6.133661 0.289729 0.262017
H 0.346005 -1.395478 -0.331215
H 0.315983 0.073206 -1.329100
H 1.568977 1.326530 0.492016
H 1.618550 -0.156001 1.469428
H -0.972885 -0.193122 1.472060
H -1.003022 1.272982 0.468150
H 2.884207 0.169619 -1.336917
H 2.931934 -1.316978 -0.367083
H -2.248323 -0.010759 -1.342532
H -2.243977 -1.457090 -0.307315
H 4.202138 -0.097590 1.449406
H 4.144528 1.397467 0.489517
H -3.552653 1.252307 0.400581
H -3.569137 -0.179922 1.457799
H 5.521105 -1.235808 -0.405626
H 5.464320 0.262581 -1.362646
H -4.786378 -0.193791 -1.388907
H 6.793704 -0.048464 1.402720
H 6.732814 1.472684 0.436267
H -7.031469 -0.140449 -0.201473
H -6.186904 0.244474 1.359861
H 8.730532 0.198844 -0.012378


