%chk=000039161.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039161

0 1
 Br  -3.555000      0.7634000      -2.372200    
 O    2.743100     -0.9131000      0.9395000    
 O   -3.196100      -2.344800     -0.7217000    
 O   -5.389400       1.766100       1.809300    
 O   -5.239100       2.422400     -0.3649000    
 C    5.733000       1.103100     -0.1152000    
 C    4.915800     -0.1035000      0.3414000    
 C    7.197200      0.7289000     -0.3432000    
 C    3.447700      0.2511000      0.5304000    
 C    8.007300       1.919700     -0.8305000    
 C    1.422200     -0.9942000      0.5822000    
 C   0.6748000      0.1693000      0.4419000    
 C   0.8438000      -2.239400      0.3659000    
 C   -1.257600      -1.159300     -0.1388000    
 C  -0.6698000      8.6499996E-02  8.0200002E-02
 C  -0.5007000      -2.322400      4.0000002E-03
 C   -2.659800      -1.245000     -0.5153000    
 C   -3.470200      1.6700000E-02 -0.6666000    
 C   -4.093500      0.4457000      0.4420000    
 C   -4.953400       1.648800      0.5315000    
 H    5.309500       1.502700      -1.044800    
 H    5.668200       1.898400      0.6373000    
 H    5.318900     -0.5019000       1.280800    
 H    4.999800     -0.9173000     -0.3899000    
 H    7.265300     -7.7200003E-02  -1.083100    
 H    7.634400      0.3518000      0.5886000    
 H    3.071300      0.6372000     -0.4260000    
 H    3.344400       1.023400       1.301400    
 H    7.615400       2.299100      -1.779600    
 H    7.985600       2.734200     -9.9399999E-02
 H    9.051300       1.630000     -0.9855000    
 H    1.086600       1.155900      0.6310000    
 H    1.429900      -3.147300      0.4765000    
 H   -1.216300       1.019700     -1.2300000E-02
 H  -0.9353000      -3.304800     -0.1606000    
 H   -3.969600     -0.1097000       1.370200    
 H   -5.966100       2.550600       1.929600    


%chk=000039161-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039161

0 1
Br -3.468362 0.724359 -1.942163
O 2.883313 -1.054937 0.007986
O -3.401863 -2.203443 0.648094
O -6.422865 1.686627 1.699322
O -5.793279 2.312701 -0.454685
C 6.049388 1.071660 -0.208531
C 5.137579 -0.174079 -0.117451
C 7.552285 0.709262 -0.231456
C 3.656669 0.205212 -0.098231
C 8.464822 1.950998 -0.320398
C 1.495229 -0.980461 0.046658
C 0.751751 0.229607 -0.010505
C 0.820891 -2.229255 0.154533
C -1.340079 -1.059629 0.127857
C -0.653815 0.179780 0.023985
C -0.575925 -2.263150 0.202663
C -2.814145 -1.155142 0.235456
C -3.696600 0.034706 -0.126818
C -4.652823 0.478055 0.737292
C -5.630055 1.567290 0.538937
H 5.802463 1.651499 -1.122506
H 5.851527 1.744160 0.652274
H 5.372705 -0.748592 0.798869
H 5.327226 -0.845267 -0.976634
H 7.751747 0.038274 -1.091342
H 7.800618 0.129376 0.680398
H 3.365709 0.734081 -1.028950
H 3.420929 0.851858 0.771927
H 8.258530 2.530888 -1.239766
H 8.305825 2.623619 0.543444
H 9.532590 1.666194 -0.334059
H 1.254052 1.197909 -0.081532
H 1.419712 -3.143498 0.199412
H -1.217499 1.117434 -0.014284
H -1.111074 -3.213291 0.299174
H -4.718132 -0.036516 1.703123
H -7.085445 2.416510 1.562008


