%chk=000093170.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093170

0 1
 Br  -2.489500      -3.295400       1.342900    
 C   0.5043000      0.1827000     -5.4400001E-02
 C  -0.1229000      -1.078700     -0.2032000    
 C    1.942800      0.2508000     -6.8999999E-03
 C   -1.524200      -1.181000     -0.2532000    
 C   -2.348900     -5.2000001E-02 -0.1592000    
 C    2.697000     -0.9471000     -0.1102000    
 C   -1.754300       1.214000     -1.0900000E-02
 C  -0.3504000       1.311000      3.8800001E-02
 C    2.679300       1.453500      0.1387000    
 C   0.6536000      -2.236400     -0.3016000    
 C    2.042100      -2.172000     -0.2558000    
 C   -2.166500      -2.534700     -0.4125000    
 C    4.101400     -0.9155000     -6.7500003E-02
 C   -3.749600     -0.1559000     -0.2096000    
 C   -2.576200       2.350300      8.3899997E-02
 C    4.076200       1.471300      0.1798000    
 C    2.115700       2.834100      0.2656000    
 C    4.787500      0.2862000      7.6700002E-02
 C   -4.551900      0.9809000     -0.1141000    
 C   -3.965500       2.233600      3.2600001E-02
 H  -1.7999999E-02   2.323100      0.1536000    
 H   0.2505000      -3.238200     -0.3917000    
 H    2.608500      -3.098600     -0.3307000    
 H   -1.585200      -3.253700     -0.9923000    
 H   -3.118100      -2.522500     -0.9473000    
 H    4.678200      -1.835400     -0.1469000    
 H   -4.283900      -1.094700     -0.2998000    
 H   -2.140900       3.340900      0.1994000    
 H    4.640300       2.394100      0.2914000    
 H    2.900300       3.596400      0.3662000    
 H    1.581500       3.128900     -0.6433000    
 H    1.530600       2.940100       1.184600    
 H    5.872700      0.2941000      0.1080000    
 H   -5.633500      0.8882000     -0.1491000    
 H   -4.588000       3.120200      0.1085000    


%chk=000093170-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000093170

0 1
Br -2.654272 -3.681114 1.068386
C 0.494117 0.199823 -0.050990
C -0.142844 -1.113213 -0.206386
C 1.976403 0.307216 0.007093
C -1.565354 -1.239486 -0.317208
C -2.416017 -0.090812 -0.167256
C 2.733996 -0.927490 -0.034733
C -1.791018 1.202680 0.008333
C -0.374317 1.309612 0.041994
C 2.738766 1.537897 0.097420
C 0.690204 -2.296600 -0.220376
C 2.057722 -2.201574 -0.129512
C -2.178835 -2.560135 -0.633983
C 4.157200 -0.938812 0.022233
C -3.853408 -0.154662 -0.163167
C -2.611811 2.375653 0.144501
C 4.151900 1.474567 0.147051
C 2.166076 2.949334 0.138904
C 4.871712 0.257163 0.113942
C -4.624037 0.999270 -0.018966
C -4.000920 2.281893 0.127452
H 0.020985 2.313678 0.163597
H 0.227391 -3.285869 -0.254309
H 2.673332 -3.108730 -0.121527
H -1.526781 -3.243921 -1.189331
H -3.150254 -2.484249 -1.136611
H 4.677538 -1.902900 -0.008925
H -4.360343 -1.121422 -0.236759
H -2.122179 3.348991 0.268499
H 4.709081 2.416278 0.213164
H 2.991108 3.681393 0.155496
H 1.545127 3.180456 -0.746423
H 1.556671 3.131927 1.043895
H 5.965728 0.261019 0.156944
H -5.717048 0.926352 -0.006989
H -4.620619 3.178385 0.235047


