%chk=000114896.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114896

0 1
 Br  -5.176500      -1.690600     -1.1000000E-03
 Cl  -5.018000       1.654200      1.7000000E-03
 Cl   5.037900      -1.635300      6.9999998E-04
 Cl   5.052600       1.599400      9.9999997E-05
 O   6.9999998E-04  -1.421700       0.000000    
 O   1.4000000E-02   1.432100     -6.0000003E-04
 C   -1.157400     -0.6864000       0.000000    
 C   -1.151000      0.7076000     -3.0000001E-04
 C    1.165800     -0.6973000       0.000000    
 C    1.172300      0.6968000     -3.9999999E-04
 C   -2.365900      -1.382300      1.9999999E-04
 C   -2.352800       1.414600     -1.9999999E-04
 C    2.367700      -1.404300      3.0000001E-04
 C    2.380700       1.392500     -6.0000003E-04
 C   -3.569200     -0.6762000      1.9999999E-04
 C   -3.562700      0.7198000       0.000000    
 C    3.577600     -0.7095000      1.9999999E-04
 C    3.584100      0.6865000     -3.0000001E-04
 H   -2.356800      -2.469700      1.9999999E-04
 H   -2.336300       2.502000     -9.9999997E-05
 H    2.351800      -2.491600      6.9999998E-04
 H    2.374900       2.480000     -7.9999998E-04


%chk=000114896-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000114896

0 1
Br -5.291966 -1.704156 0.000078
Cl -5.147918 1.687126 0.000225
Cl 5.169713 -1.663835 0.000305
Cl 5.183068 1.629491 -0.000160
O 0.000289 -1.457364 -0.000024
O 0.012524 1.464819 -0.000365
C -1.195845 -0.700955 -0.000022
C -1.189488 0.718667 -0.000157
C 1.202891 -0.711218 0.000010
C 1.208930 0.708570 -0.000195
C -2.410358 -1.399982 0.000059
C -2.396537 1.428169 -0.000061
C 2.410696 -1.420491 0.000188
C 2.422231 1.408251 -0.000211
C -3.631524 -0.687846 0.000068
C -3.623459 0.727197 0.000117
C 3.635911 -0.718274 0.000151
C 3.641725 0.696220 -0.000033
H -2.394830 -2.493008 0.000125
H -2.375732 2.521341 -0.000134
H 2.391514 -2.513676 0.000320
H 2.411666 2.501553 -0.000384


