%chk=000138448.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138448

0 1
 Br   4.062300      0.7535000     -1.1000000E-03
 S   -1.557600       1.567000      3.0000001E-04
 N   -1.757300      -1.004400       0.000000    
 C  -9.3099996E-02  0.6568000      3.0000001E-04
 C  -0.4024000     -0.7067000      9.9999997E-05
 C   -2.452200      0.1092000      1.9999999E-04
 C    1.233700       1.116300      5.0000002E-04
 C   0.6557000      -1.641400       0.000000    
 C    2.262000      0.1704000      5.0000002E-04
 C    1.979000      -1.191100      1.9999999E-04
 C   -3.929900      0.1704000     -8.9999998E-04
 H    1.447000       2.181600      3.9999999E-04
 H   0.4458000      -2.707300     -3.0000001E-04
 H    2.780200      -1.926400     -9.9999997E-05
 H   -4.302700      0.6899000      0.8877000    
 H   -4.301300      0.6880000     -0.8912000    
 H   -4.356300     -0.8381000     -1.9999999E-04


%chk=000138448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138448

0 1
Br 4.169478 0.729157 0.000481
S -1.555904 1.710707 -0.000293
N -1.759175 -0.982211 -0.000416
C -0.049472 0.707588 -0.000109
C -0.379856 -0.687862 -0.000234
C -2.509563 0.094625 -0.000416
C 1.287193 1.152285 0.000109
C 0.654832 -1.650963 -0.000146
C 2.289772 0.161138 0.000189
C 1.997486 -1.225638 0.000065
C -4.006648 0.129821 -0.000662
H 1.546362 2.213455 0.000194
H 0.398887 -2.714016 -0.000239
H 2.810050 -1.956667 0.000125
H -4.396112 0.655441 0.889986
H -4.395797 0.653917 -0.892354
H -4.388632 -0.903077 0.000119


