%chk=000008213.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008213

0 1
 Br  -10.48670     -0.6063000      8.1400000E-02
 C  -1.2100000E-02 -0.3885000     -0.1055000    
 C    1.291400      0.4155000     -0.1310000    
 C   -1.266900      0.4855000     -6.0400002E-02
 C    2.584000     -0.4055000     -9.0099998E-02
 C   -2.535300     -0.3698000     -1.4400000E-02
 C    3.850400      0.4525000     -5.4099999E-02
 C   -3.793900      0.5008000     -2.0999999E-03
 C    5.108900     -0.4184000     -5.5000000E-03
 C   -5.060200     -0.3577000      6.2000002E-03
 C    6.373400      0.4401000      6.3800000E-02
 C   -6.353300      0.4630000      2.7000001E-02
 C    7.666600     -0.3803000      9.2600003E-02
 C   -7.654200     -0.3439000     -2.1000000E-02
 C    8.967000      0.4270000      7.7200003E-02
 C   -8.897700      0.5219000      9.3400002E-02
 C    10.21870     -0.4359000      4.2500000E-02
 H  -4.7800001E-02  -1.036100     -0.9901000    
 H  -2.7000001E-03  -1.049700      0.7699000    
 H    1.300300       1.043400      -1.031000    
 H    1.291400       1.103300      0.7244000    
 H   -1.290000       1.135600     -0.9433000    
 H   -1.230200       1.137000      0.8209000    
 H    2.563300      -1.055000      0.7937000    
 H    2.614100      -1.064800     -0.9663000    
 H   -2.559200      -1.035700     -0.8857000    
 H   -2.518800      -1.006000      0.8788000    
 H    3.881200       1.098100     -0.9400000    
 H    3.821800       1.108600      0.8242000    
 H   -3.784600       1.150400      0.8813000    
 H   -3.801100       1.152900     -0.8838000    
 H    5.147600      -1.059100     -0.8947000    
 H    5.068900      -1.079100      0.8688000    
 H   -5.046100      -1.020700      0.8801000    
 H   -5.064700      -1.003500     -0.8806000    
 H    6.399700       1.112200     -0.8029000    
 H    6.335800       1.076700      0.9564000    
 H   -6.344200       1.158700     -0.8218000    
 H   -6.355900       1.082100      0.9333000    
 H    7.658300      -1.020500      0.9840000    
 H    7.668400      -1.056400     -0.7721000    
 H   -7.641600      -1.079500      0.7935000    
 H   -7.683600     -0.9187000     -0.9553000    
 H    8.970500       1.088500     -0.7972000    
 H    9.001400       1.071900      0.9631000    
 H   -8.920900       1.082500       1.031800    
 H   -8.994000       1.212200     -0.7487000    
 H    10.26710      -1.087900      0.9203000    
 H    10.23490      -1.064400     -0.8535000    
 H    11.11440      0.1930000      3.4499999E-02


%chk=000008213-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008213

0 1
Br -10.683655 -0.609812 -0.018476
C 0.006650 -0.383745 -0.009813
C 1.301520 0.459736 0.002303
C -1.280914 0.470749 -0.001778
C 2.589375 -0.394398 -0.006180
C -2.575905 -0.372360 -0.013294
C 3.884374 0.448819 0.005914
C -3.862231 0.484088 -0.004519
C 5.172153 -0.405298 -0.003022
C -5.156582 -0.359897 -0.014669
C 6.467482 0.437644 0.009546
C -6.441345 0.501024 -0.004073
C 7.755233 -0.416779 0.000536
C -7.729712 -0.363338 -0.015293
C 9.050745 0.426823 0.015088
C -8.981516 0.514582 -0.002013
C 10.331759 -0.435376 0.006117
H 0.005522 -1.039878 -0.905443
H 0.002536 -1.060608 0.870233
H 1.305650 1.137115 -0.877371
H 1.303091 1.115328 0.898343
H -1.276411 1.147557 -0.881906
H -1.278921 1.127002 0.893814
H 2.585381 -1.071580 0.873664
H 2.587912 -1.050382 -0.901961
H -2.577967 -1.028210 -0.909035
H -2.579989 -1.049263 0.866640
H 3.888289 1.126525 -0.873588
H 3.886102 1.104469 0.902003
H -3.858638 1.140313 0.890964
H -3.857651 1.160058 -0.885155
H 5.170658 -1.060822 -0.899180
H 5.168173 -1.083222 0.876301
H -5.161369 -1.035693 0.865456
H -5.161590 -1.014295 -0.910824
H 6.471788 1.115482 -0.869862
H 6.469276 1.093062 0.905829
H -6.436484 1.175852 -0.884915
H -6.436716 1.153317 0.893613
H 7.751982 -1.095684 0.879108
H 7.755797 -1.071083 -0.896502
H -7.735484 -1.034013 0.864661
H -7.736719 -1.009109 -0.913680
H 9.053017 1.104764 -0.862935
H 9.048774 1.080374 0.911439
H -9.065600 1.124456 0.911153
H -9.065908 1.151488 -0.896496
H 10.366354 -1.101417 0.889072
H 10.372126 -1.074491 -0.896275
H 11.243388 0.190125 0.018462


