%chk=000067098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067098

0 1
 Br  -5.122700       2.185000      -1.080700    
 O   0.2337000      -2.157000      0.6676000    
 O   -4.757200      -1.265700      1.5000000E-03
 O    6.147200      0.3018000      0.1321000    
 C   -2.388400     -0.5872000      6.3699998E-02
 C   -1.766600      0.8111000     -0.1329000    
 C  -0.2972000      0.8584000      0.2914000    
 C   0.5028000     -0.1134000     -0.6312000    
 C   -1.616800      -1.589100     -0.8156000    
 C   -3.824800     -0.2852000     -0.4201000    
 C   -2.778200       1.746000      0.5290000    
 C  -8.7800004E-02  -1.552400     -0.5824000    
 C   -4.134700       1.093200      0.2019000    
 C   0.2968000       2.263900      0.1819000    
 C   -2.425800      -1.082300       1.533100    
 C    2.009000     -1.1600000E-02 -0.3967000    
 C    1.720100       2.266100      0.7296000    
 C    2.569000       1.131400      0.2134000    
 C    2.882600      -1.010900     -0.8625000    
 C    3.960400       1.217000      0.3972000    
 C  -0.1874000      -3.512200      0.7107000    
 C    4.263600     -0.9089000     -0.6833000    
 C    4.802600      0.2020000     -4.7699999E-02
 H   -1.791400       1.057100      -1.208100    
 H  -0.2003000      0.5413000       1.337200    
 H   0.3624000      0.2377000      -1.666000    
 H   -1.781100      -1.320000      -1.868800    
 H   -2.046400      -2.589900     -0.7117000    
 H   -3.856300     -0.2575000      -1.515900    
 H   -2.624500       1.767400       1.614200    
 H   -2.679200       2.774200      0.1670000    
 H   0.3733000      -2.148100      -1.380300    
 H   -4.779400       1.041700       1.084700    
 H  -0.2985000       2.990200      0.7463000    
 H   0.2967000       2.593300     -0.8652000    
 H   -1.443700      -1.099400       2.008000    
 H   -3.054100     -0.4502000       2.169400    
 H   -2.840600      -2.094300       1.593900    
 H    1.686100       2.192900       1.824200    
 H    2.188500       3.225500      0.4783000    
 H   -4.921900      -1.157100      0.9527000    
 H    2.506600      -1.888200      -1.380300    
 H    4.381600       2.091000      0.8902000    
 H   4.4000000E-02  -4.044900     -0.2175000    
 H   -1.246500      -3.605700      0.9572000    
 H   0.3668000      -4.000600       1.518300    
 H    4.911400      -1.701800      -1.047300    
 H    6.343600       1.137900      0.5885000    


%chk=000067098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067098

0 1
Br -5.222682 2.338052 -1.207082
O 0.235497 -2.094028 0.773805
O -4.923252 -1.237830 -0.171923
O 6.209310 0.157284 -0.035414
C -2.455699 -0.554968 0.060248
C -1.808870 0.856295 -0.102379
C -0.333033 0.888013 0.330661
C 0.448988 -0.091374 -0.599073
C -1.667821 -1.561570 -0.808897
C -3.900399 -0.237571 -0.459613
C -2.842260 1.814121 0.537821
C -0.133592 -1.531223 -0.539798
C -4.205080 1.176354 0.142466
C 0.306094 2.289015 0.253402
C -2.533987 -1.043807 1.532070
C 1.969127 -0.020268 -0.390572
C 1.739292 2.245518 0.820066
C 2.572095 1.102777 0.243585
C 2.821203 -1.041595 -0.887633
C 3.982737 1.169577 0.365526
C 0.198311 -3.553000 0.818930
C 4.220779 -0.981344 -0.768039
C 4.803730 0.136428 -0.132049
H -1.822281 1.074430 -1.196655
H -0.240881 0.530598 1.376996
H 0.244191 0.253064 -1.640305
H -1.818758 -1.315620 -1.880945
H -2.052428 -2.589858 -0.667596
H -3.891255 -0.187569 -1.561725
H -2.744891 1.833947 1.640783
H -2.751568 2.851644 0.180922
H 0.346877 -2.152879 -1.329760
H -4.926062 1.120548 0.974635
H -0.296193 3.020614 0.825138
H 0.321504 2.632353 -0.801764
H -1.527302 -1.184026 1.953482
H -3.097533 -0.349015 2.183811
H -3.033872 -2.030974 1.570853
H 1.681493 2.123891 1.922366
H 2.255316 3.208792 0.642385
H -5.035547 -1.314929 0.809931
H 2.386860 -1.917105 -1.382335
H 4.435423 2.044867 0.853733
H 0.844389 -3.994605 0.030409
H -0.830701 -3.953242 0.704487
H 0.588200 -3.837622 1.809143
H 4.866613 -1.775410 -1.153600
H 6.515214 0.975749 0.428505


