%chk=000105380.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105380

0 1
 Br  -3.900000      -1.739900      -3.159400    
 Br   4.435600      -2.109300       3.039200    
 Br  -3.013900      0.3845000       2.103300    
 Br   3.559900      0.5342000      -1.984700    
 O   -4.405600     -2.9500000E-02 -0.6304000    
 O    4.949300     -0.1569000      0.6937000    
 O   -6.471500       1.557300      0.3964000    
 O    6.697100       1.956600      0.2227000    
 O   -8.423000       2.555400     -0.3353000    
 O    5.699100       4.037100      9.7099997E-02
 C   0.2953000      -3.248600     -0.1221000    
 C  -0.9905000      -2.367500     -0.2613000    
 C    1.524300      -2.431600      9.3500003E-02
 C  -4.9199998E-02  -4.275300       1.022000    
 C   0.5169000      -4.159800      -1.380300    
 C   -1.377500      -1.528300      0.7836000    
 C    1.915000      -1.493900     -0.8624000    
 C   -1.749900      -2.421600      -1.430100    
 C    2.283100      -2.605600       1.250900    
 C   -2.896100      -1.636400      -1.554000    
 C    3.432600      -1.841600       1.452400    
 C   -2.523800     -0.7433000      0.6596000    
 C    3.064600     -0.7302000     -0.6608000    
 C   -3.283000     -0.7973000     -0.5092000    
 C    3.823400     -0.9040000      0.4966000    
 C   -5.632200     -0.6064000     -0.1910000    
 C    4.788800       1.084100       1.375000    
 C   -6.749600      0.4006000     -0.3835000    
 C    6.144000       1.749600       1.516800    
 C   -7.395800       2.558000      0.3244000    
 C    6.391400       3.146600     -0.3700000    
 C   -6.938300       3.664100       1.190500    
 C    7.046700       3.178000      -1.694000    
 C   -7.670300       4.776800       1.297300    
 C    6.903300       4.244200      -2.486400    
 H  -0.9707000      -4.825400      0.7917000    
 H   0.7477000      -5.018900       1.144900    
 H  -0.2051000      -3.787600       1.991300    
 H  -0.3255000      -4.841200      -1.549900    
 H   0.6794000      -3.583100      -2.298200    
 H    1.408800      -4.785700      -1.244600    
 H  -0.7846000      -1.480600       1.693700    
 H    1.324800      -1.350900      -1.764600    
 H   -1.480500      -3.058300      -2.265200    
 H    2.008700      -3.325900       2.014300    
 H   -5.555000     -0.8697000      0.8699000    
 H   -5.852900      -1.515500     -0.7605000    
 H    4.356800      0.9206000       2.368300    
 H    4.110300       1.729900      0.8070000    
 H   -6.806500      0.6919000      -1.438800    
 H   -7.703900     -3.7200000E-02 -7.0500001E-02
 H    6.078600       2.681600       2.089500    
 H    6.832500       1.084200       2.048700    
 H   -6.005800       3.558700       1.733600    
 H    7.640000       2.327400      -2.010000    
 H   -7.333700       5.588700       1.933400    
 H   -8.606500       4.912000      0.7671000    
 H    7.384000       4.266100      -3.458800    
 H    6.315900       5.109300      -2.199100    


%chk=000105380-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105380

0 1
Br -4.163402 -2.090093 -2.964375
Br 4.914629 -2.611751 2.759056
Br -2.665128 0.591959 1.980846
Br 3.344612 0.579780 -1.853650
O -4.309779 0.007871 -0.635630
O 5.154142 -0.426909 0.512386
O -6.446831 1.844793 0.329073
O 6.756516 2.056404 -0.079159
O -8.291442 2.790133 -0.750728
O 5.554320 3.934660 0.631356
C 0.267354 -3.540799 -0.037009
C -0.958994 -2.613174 -0.229382
C 1.537099 -2.679611 0.187383
C -0.036392 -4.473816 1.172242
C 0.529652 -4.437981 -1.282599
C -1.224908 -1.616040 0.746258
C 1.816537 -1.617851 -0.712846
C -1.850458 -2.741810 -1.320237
C 2.470037 -2.955029 1.214811
C -2.972228 -1.895038 -1.422854
C 3.643198 -2.183501 1.331797
C -2.348327 -0.781658 0.628326
C 2.992271 -0.861042 -0.581848
C -3.255222 -0.892674 -0.461143
C 3.943225 -1.120667 0.443190
C -5.612438 -0.401674 -0.040231
C 5.143771 0.799678 1.358434
C -6.652301 0.612187 -0.471538
C 6.522702 1.435248 1.248456
C -7.349078 2.888496 0.073491
C 6.195282 3.329816 -0.264745
C -7.006977 4.065399 0.912022
C 6.485194 3.809854 -1.639421
C -7.742210 5.205778 0.855603
C 6.058769 5.027672 -2.063421
H -0.980437 -5.016399 0.990220
H 0.761093 -5.226623 1.308892
H -0.149985 -3.906295 2.112919
H -0.309850 -5.135492 -1.457313
H 0.688254 -3.838234 -2.196369
H 1.439454 -5.040570 -1.116692
H -0.540884 -1.480901 1.589601
H 1.106698 -1.377219 -1.510091
H -1.680646 -3.489128 -2.098169
H 2.295315 -3.763768 1.927142
H -5.521423 -0.435842 1.061748
H -5.889539 -1.402168 -0.427524
H 4.955945 0.510337 2.411913
H 4.350508 1.489068 1.017635
H -6.555129 0.850943 -1.545064
H -7.673374 0.230051 -0.284633
H 6.632603 2.205947 2.032872
H 7.308497 0.669210 1.333004
H -6.133626 3.959564 1.563785
H 7.053557 3.128140 -2.280474
H -7.492475 6.078579 1.467545
H -8.608087 5.275343 0.186597
H 6.267882 5.386332 -3.076452
H 5.489454 5.681015 -1.391707


