%chk=000040236.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040236

0 1
 Br  0.3772000       3.240500       0.000000    
 Br   3.873600      -1.265800      1.9999999E-04
 O   -1.749400      0.7504000      3.0000001E-04
 N   -1.504800      -1.502800     -9.9999997E-05
 N   -3.685300     -0.4864000      3.0000001E-04
 C  -0.4125000      0.4722000     -9.9999997E-05
 C  -0.2667000     -0.9071000     -1.9999999E-04
 C   0.6397000       1.379600     -9.9999997E-05
 C    1.025300      -1.452100       0.000000    
 C    1.921900      0.8198000       0.000000    
 C    2.113500     -0.5673000       0.000000    
 C   -2.332400     -0.4811000     -3.0000001E-04
 H    1.167500      -2.528200       0.000000    
 H    2.788600       1.479500       0.000000    
 H   -4.224100      0.3734000      9.9999997E-05
 H   -4.217400      -1.350400       0.000000    


%chk=000040236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040236

0 1
Br 0.417244 3.327463 0.000043
Br 3.938781 -1.309040 -0.000063
O -1.798486 0.809767 0.000074
N -1.538004 -1.514988 0.000050
N -3.753049 -0.517045 0.000086
C -0.409562 0.521383 0.000036
C -0.258070 -0.900040 0.000037
C 0.674219 1.397431 0.000020
C 1.029284 -1.472370 0.000001
C 1.974680 0.836459 -0.000017
C 2.117116 -0.574055 -0.000027
C -2.391567 -0.492502 0.000030
H 1.167272 -2.555023 -0.000004
H 2.852956 1.485615 -0.000026
H -4.284745 0.348632 -0.000118
H -4.223368 -1.417487 -0.000021


