%chk=000096741.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096741

0 1
 Br   7.823200      -1.529700      0.6793000    
 O  -0.4988000       1.933100     -0.4201000    
 O    2.482100      -1.795600     -0.3897000    
 N   0.3353000     -0.1545000      0.1364000    
 N    1.636200      0.2914000      0.1508000    
 C   -4.442700      0.5318000      0.1584000    
 C   -4.661300     -0.8418000     -0.1031000    
 C   -2.051700      0.1958000     -0.1408000    
 C   -3.131700       1.034900      0.1354000    
 C   -3.562700      -1.671800     -0.3797000    
 C   -2.266900      -1.155000     -0.3982000    
 C   -5.541500       1.361700      0.4347000    
 C   -5.972300      -1.345100     -8.0300003E-02
 C  -0.7004000      0.7327000     -0.1614000    
 C   -6.837100      0.8446000      0.4533000    
 C   -7.052200     -0.5062000      0.1964000    
 C    4.028600     -5.9000000E-02 -7.3100001E-02
 C    2.648500     -0.6073000     -0.1261000    
 C    5.072600     -0.9095000      0.2249000    
 C    4.220500       1.283700     -0.3234000    
 C    6.367700     -0.3940000      0.2746000    
 C    5.515500       1.799400     -0.2736000    
 C    6.589100      0.9604000      2.5400000E-02
 H   -2.961100       2.090500      0.3407000    
 H   -3.708500      -2.729500     -0.5896000    
 H   -1.457000      -1.835500     -0.6448000    
 H   -5.397400       2.420800      0.6384000    
 H   -6.163900      -2.397700     -0.2783000    
 H   -7.678200       1.497200      0.6685000    
 H   -8.061100     -0.9080000      0.2110000    
 H   0.1938000      -1.118700      0.4182000    
 H    1.774700       1.252700      0.4429000    
 H    4.899300      -1.963600      0.4243000    
 H    3.416300       1.961500     -0.5900000    
 H    5.689300       2.852500     -0.4747000    
 H    7.592200       1.377900      5.8499999E-02


%chk=000096741-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096741

0 1
Br 7.967119 -1.655429 -0.272432
O -0.466133 1.916320 0.067667
O 2.486317 -1.811795 -0.068906
N 0.354334 -0.223014 0.004975
N 1.639484 0.319009 0.008974
C -4.512689 0.519214 0.071655
C -4.773886 -0.906297 0.027696
C -2.086045 0.077517 0.031618
C -3.159479 0.977485 0.072216
C -3.659442 -1.809351 -0.013976
C -2.349426 -1.336484 -0.012203
C -5.621314 1.429402 0.113362
C -6.130602 -1.366558 0.027021
C -0.711820 0.659344 0.036265
C -6.933687 0.952210 0.111769
C -7.190144 -0.456222 0.068263
C 4.082814 0.044004 -0.020174
C 2.708865 -0.551990 -0.028042
C 5.161663 -0.871521 -0.125082
C 4.348015 1.434524 0.087898
C 6.479114 -0.384259 -0.124387
C 5.679510 1.899684 0.086890
C 6.761155 0.994328 -0.020563
H -2.935531 2.049654 0.104633
H -3.852592 -2.887827 -0.047820
H -1.530965 -2.064518 -0.045930
H -5.421322 2.506724 0.146551
H -6.326731 -2.444762 -0.006390
H -7.774811 1.652975 0.143805
H -8.224762 -0.816249 0.067609
H 0.351023 -1.247231 -0.023659
H 1.631415 1.344728 0.028254
H 4.931687 -1.937972 -0.202812
H 3.538965 2.167442 0.180586
H 5.884846 2.971665 0.171508
H 7.793457 1.355350 -0.021636


