%chk=000097603.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097603

0 1
 Br   5.295000      -1.396700      1.9999999E-04
 C   0.1675000      0.3221000     -1.9999999E-04
 C  -0.2115000      -1.042700     -1.9999999E-04
 C   -1.568600      -1.410000     -1.9999999E-04
 C    1.567800      0.6625000     -9.9999997E-05
 C   -2.590800     -0.4514000     -9.9999997E-05
 C   -2.244600      0.9117000     -9.9999997E-05
 C  -0.8840000       1.274200     -9.9999997E-05
 C    2.533700     -0.3776000     -9.9999997E-05
 C   0.7688000      -2.038800     -1.9999999E-04
 C    2.120500      -1.711700     -9.9999997E-05
 C   -1.945200      -2.868900      6.0000003E-04
 C   -3.947000     -0.8202000     -9.9999997E-05
 C    2.065100       1.990100     -9.9999997E-05
 C   -3.265700       1.877900       0.000000    
 C    3.907200     -7.9700001E-02  9.9999997E-05
 C   -4.948800      0.1502000       0.000000    
 C   -4.608300       1.498700      3.0000001E-04
 C    3.433900       2.273000      9.9999997E-05
 C    4.355200       1.237500      1.9999999E-04
 H  -0.6516000       2.337800      9.9999997E-05
 H   0.5480000      -3.100600     -3.2299999E-02
 H    2.816500      -2.545100     -7.1000000E-03
 H   -2.917200      -3.089600      0.4441000    
 H   -1.925400      -3.265700      -1.019400    
 H   -1.284000      -3.465500      0.6368000    
 H    1.391300       2.842900     -9.9999997E-05
 H   -4.296700      -1.845300     -3.2900002E-02
 H   -3.022100       2.938400     -3.9999999E-04
 H   -5.993700     -0.1460000     -7.4000000E-03
 H   -5.386400       2.256400     -1.3000000E-03
 H    3.773400       3.304700      1.9999999E-04
 H    5.414900       1.479000      3.0000001E-04


%chk=000097603-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097603

0 1
Br 5.385670 -1.385789 -0.034550
C 0.158888 0.282261 -0.001930
C -0.232986 -1.119633 -0.000991
C -1.608403 -1.503958 0.005682
C 1.588284 0.646264 -0.009480
C -2.627575 -0.493717 0.011339
C -2.231229 0.909175 0.010461
C -0.856389 1.257151 0.003955
C 2.585844 -0.400484 -0.016277
C 0.818399 -2.118824 -0.007486
C 2.154806 -1.781900 -0.014656
C -1.958983 -2.984800 0.005860
C -4.041298 -0.782067 0.017889
C 2.022526 2.004159 -0.010574
C -3.241191 1.934423 0.016012
C 3.963236 -0.016215 -0.024165
C -4.994425 0.234426 0.023214
C -4.594283 1.611709 0.022245
C 3.383632 2.337249 -0.018209
C 4.375114 1.320368 -0.025236
H -0.609264 2.323270 0.002890
H 0.544553 -3.177223 -0.006589
H 2.918511 -2.564933 -0.019189
H -3.042689 -3.163701 0.012835
H -1.551665 -3.493593 -0.887935
H -1.539907 -3.496434 0.892533
H 1.289123 2.814310 -0.005322
H -4.386751 -1.819460 0.018747
H -2.920631 2.983146 0.015190
H -6.060609 -0.017753 0.028268
H -5.354968 2.399666 0.026341
H 3.694299 3.387124 -0.018894
H 5.437561 1.577381 -0.031477


