%chk=000030505.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030505

0 1
 Br -0.9787000       3.057900      1.4000000E-03
 C   -1.167100      0.1846000     -3.0000001E-04
 C    1.134800       1.191200      1.9999999E-04
 C    3.896700       1.023300      1.9999999E-04
 C  -0.3398000       1.280100      1.9999999E-04
 C   -2.613900      0.3344000     -3.9999999E-04
 C  -0.5386000      -1.176800      9.9999997E-05
 C    5.385300      0.9319000     -1.9999999E-04
 C    1.808200       1.151200      -1.207700    
 C    1.808300       1.149400       1.208300    
 C    3.200400       1.066400      -1.207800    
 C    3.200600       1.064700       1.208200    
 C   -3.307600      0.4066000       1.207600    
 C  -0.2651000      -1.769500      -1.207800    
 C   -3.307700      0.4059000      -1.208500    
 C  -0.2652000      -1.769000       1.208200    
 C    5.878500     -0.5127000     -1.9000000E-03
 C   -4.695100      0.5500000       1.207600    
 C   0.3192000      -3.036100      -1.207600    
 C   -4.695200      0.5494000      -1.208300    
 C   0.3193000      -3.035500       1.208300    
 C   -5.388900      0.6214000     -1.9999999E-04
 C   0.6115000      -3.669000      3.9999999E-04
 H    5.792300       1.456300     -0.8738000    
 H    5.792600       1.454500      0.8744000    
 H    1.277400       1.183900      -2.155400    
 H    1.277500       1.180800       2.156000    
 H    3.730900       1.032600      -2.155700    
 H    3.731100       1.029600       2.156100    
 H   -2.782500      0.3537000       2.158400    
 H  -0.4888000      -1.284600      -2.153300    
 H   -2.782700      0.3526000      -2.159300    
 H  -0.4889000      -1.283700       2.153500    
 H    5.525300      -1.052700      0.8832000    
 H    6.972700     -0.5383000     -2.0999999E-03
 H    5.525000      -1.050800     -0.8880000    
 H   -5.235300      0.6065000       2.148100    
 H   0.5471000      -3.529100      -2.148100    
 H   -5.235500      0.6055000      -2.148700    
 H   0.5473000      -3.528200       2.148900    
 H   -6.469100      0.7333000     -1.9999999E-04
 H    1.066900      -4.655000      6.0000003E-04


%chk=000030505-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030505

0 1
Br -0.994626 3.149937 0.000061
C -1.139611 0.236941 0.000049
C 1.212917 1.238733 0.000110
C 4.075652 1.154252 -0.000017
C -0.273615 1.286628 0.000160
C -2.638299 0.369830 0.000019
C -0.604393 -1.176222 -0.000059
C 5.593905 1.053088 -0.000104
C 1.936475 1.227080 -1.220686
C 1.936558 1.226362 1.220843
C 3.345672 1.181950 -1.216589
C 3.345758 1.181234 1.216620
C -3.356819 0.407924 1.222257
C -0.375389 -1.859724 -1.222004
C -3.356868 0.407017 -1.222217
C -0.375082 -1.859743 1.221818
C 6.081975 -0.421629 -0.001112
C -4.766966 0.491379 1.222183
C 0.078227 -3.197252 -1.222169
C -4.767015 0.490479 -1.222148
C 0.078511 -3.197278 1.221851
C -5.477004 0.531682 0.000017
C 0.306108 -3.871347 -0.000192
H 6.005836 1.568716 -0.888610
H 6.005846 1.567513 0.889092
H 1.389231 1.259875 -2.169507
H 1.389389 1.258588 2.169729
H 3.888962 1.172363 -2.169700
H 3.889117 1.171079 2.169685
H -2.809022 0.384900 2.171315
H -0.550211 -1.340153 -2.171254
H -2.809118 0.383280 -2.171285
H -0.549700 -1.340186 2.171113
H 5.711456 -0.959621 0.890152
H 7.186369 -0.471210 -0.001156
H 5.711447 -0.958408 -0.893104
H -5.309442 0.527640 2.173667
H 0.254689 -3.711182 -2.173815
H -5.309532 0.526039 -2.173635
H 0.255191 -3.711225 2.173447
H -6.570836 0.596597 0.000017
H 0.657454 -4.909225 -0.000245


