%chk=000060914.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060914

0 1
 Br   2.182400       2.741300      8.5199997E-02
 C    1.002200      0.1621000     -0.5756000    
 C    1.034400     -0.9506000      0.4657000    
 C  -0.3015000      0.8201000     -0.9746000    
 C   0.3953000     -9.3099996E-02  -1.936700    
 C    2.333800      0.8791000     -0.4581000    
 C    3.018600      6.6100001E-02  0.6747000    
 C    1.838700     -0.2913000       1.593000    
 C    2.025800      -2.029300     -1.2400000E-02
 C    3.390400      -1.326100      0.1232000    
 C   -1.597200      0.4002000     -0.3858000    
 C   -1.965500      0.8366000      0.8903000    
 C   -2.458200     -0.4349000      -1.103900    
 C   -3.183600      0.4415000       1.443300    
 C   -3.676500     -0.8300000     -0.5510000    
 C   -4.039000     -0.3917000      0.7227000    
 H   7.0799999E-02  -1.361300      0.7703000    
 H  -0.2654000       1.868100      -1.264000    
 H   2.8200001E-02  -1.093100      -2.133000    
 H   0.8665000      0.3615000      -2.801800    
 H    2.913700      0.8664000      -1.386000    
 H    3.854400      0.5710000       1.164700    
 H    2.110400     -0.9877000       2.393600    
 H    1.338900      0.5810000       2.024900    
 H    1.842400      -2.359400      -1.039200    
 H    1.990800      -2.908000      0.6416000    
 H    4.023200      -1.870000      0.8334000    
 H    3.920300      -1.269600     -0.8329000    
 H   -1.306800       1.486400       1.461000    
 H   -2.215200     -0.7760000      -2.106100    
 H   -3.466000      0.7829000       2.434900    
 H   -4.345100      -1.474800      -1.113700    
 H   -4.988000     -0.6983000       1.152700    


%chk=000060914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060914

0 1
Br 2.057083 2.790679 0.430627
C 1.023244 0.106388 -0.612210
C 1.047609 -1.115228 0.338265
C -0.305573 0.824287 -0.996339
C 0.459607 0.009520 -2.037040
C 2.330017 0.856271 -0.308995
C 3.002785 -0.021265 0.772773
C 1.771468 -0.521619 1.581888
C 2.120562 -2.111206 -0.197573
C 3.466796 -1.336099 0.052955
C -1.617821 0.413247 -0.395432
C -2.139153 1.179988 0.682943
C -2.366067 -0.701910 -0.852297
C -3.367284 0.839798 1.288023
C -3.596852 -1.045942 -0.247481
C -4.102389 -0.277988 0.825983
H 0.055098 -1.558351 0.512398
H -0.182972 1.911319 -1.076286
H 0.062032 -0.961789 -2.350751
H 0.965042 0.562324 -2.835707
H 2.959196 1.066412 -1.186996
H 3.799533 0.493736 1.328437
H 2.036868 -1.286775 2.332174
H 1.215249 0.296103 2.069708
H 1.965175 -2.354087 -1.263395
H 2.092760 -3.057442 0.372735
H 4.145653 -1.901374 0.716124
H 4.017958 -1.125975 -0.881810
H -1.570685 2.045772 1.044825
H -1.997757 -1.293598 -1.698198
H -3.752759 1.444107 2.117070
H -4.163573 -1.907483 -0.618994
H -5.057649 -0.542718 1.292978


