%chk=000086045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086045

0 1
 Br   5.204700       2.482300     -0.1862000    
 O    6.352500      -1.352600      0.4080000    
 O    7.202000      0.4149000     -0.8018000    
 C   -2.535700      0.3910000      0.2942000    
 C   -1.232500     -0.2827000     -0.1388000    
 C   -3.755400     -0.4033000     -0.1758000    
 C  -1.1600000E-02  0.4938000      0.3603000    
 C   -5.058900      0.2874000      0.2281000    
 C    1.289800     -0.1619000     -0.1066000    
 C   -6.278100     -0.4896000     -0.2711000    
 C    2.549400      0.5664000      0.3739000    
 C   -7.582000      0.1832000      0.1614000    
 C    3.849300     -5.5100001E-02 -0.1509000    
 C   -8.800000     -0.5749000     -0.3659000    
 C    5.095100      0.6252000      0.4100000    
 C   -10.09780      0.1090000      3.3500001E-02
 C    6.349500     -7.1099997E-02 -7.0600003E-02
 C    7.459600      -2.162000     -1.5000000E-03
 H   -2.557900      0.4830000       1.387000    
 H   -2.576400       1.407100     -0.1168000    
 H   -1.203000     -0.3526000      -1.232900    
 H   -1.199500      -1.307000      0.2519000    
 H   -3.722300     -0.5134000      -1.266600    
 H   -3.725200      -1.412700      0.2521000    
 H  -2.6200000E-02  0.5410000       1.455800    
 H  -5.3300001E-02   1.525500     -9.2000002E-03
 H   -5.101500      0.3785000       1.320200    
 H   -5.080000       1.304300     -0.1824000    
 H    1.321100      -1.199800      0.2478000    
 H    1.298000     -0.2019000      -1.203100    
 H   -6.248000      -1.514000      0.1198000    
 H   -6.244500     -0.5598000      -1.365100    
 H    2.473500       1.613000      5.9999999E-02
 H    2.563600      0.5636000       1.470900    
 H   -7.625300      0.2345000       1.256100    
 H   -7.603000       1.214600     -0.2114000    
 H    3.853900      -1.119200      0.1164000    
 H    3.854100     -1.6100001E-02  -1.248200    
 H   -8.752600     -0.6425000      -1.459200    
 H   -8.797500      -1.599800      2.3000000E-02
 H    5.098800      0.6634000       1.503600    
 H   -10.19180      0.1661000       1.122600    
 H   -10.95550     -0.4505000     -0.3528000    
 H   -10.14600       1.125600     -0.3697000    
 H    7.340800      -3.152100      0.4467000    
 H    8.398700      -1.726400      0.3528000    
 H    7.468400      -2.268300      -1.090400    


%chk=000086045-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086045

0 1
Br 5.386444 2.140606 0.154697
O 7.335526 -0.672739 0.812863
O 6.484553 -0.933260 -1.344300
C -2.632875 0.253803 0.290919
C -1.333958 -0.337649 -0.301456
C -3.916209 -0.328296 -0.343387
C -0.051475 0.240791 0.337640
C -5.215246 0.264364 0.247685
C 1.246650 -0.346712 -0.259819
C -6.498952 -0.319957 -0.384185
C 2.525203 0.229652 0.389423
C -7.798260 0.272255 0.206877
C 3.810432 -0.352410 -0.233396
C -9.081883 -0.313575 -0.424882
C 5.108968 0.116016 0.425522
C -10.375148 0.283308 0.171346
C 6.351377 -0.539847 -0.164520
C 8.620980 -1.255382 0.351918
H -2.651505 0.072916 1.386212
H -2.626772 1.356099 0.158787
H -1.313614 -0.152681 -1.395899
H -1.342185 -1.440484 -0.173197
H -3.897421 -0.148698 -1.438859
H -3.923010 -1.430556 -0.210040
H -0.070469 0.052124 1.431549
H -0.045140 1.343708 0.212804
H -5.233154 0.086789 1.343546
H -5.209671 1.366349 0.112439
H 1.236167 -1.450866 -0.143550
H 1.269369 -0.148655 -1.351526
H -6.504497 -1.422039 -0.248938
H -6.481344 -0.142324 -1.480069
H 2.529977 1.331348 0.279707
H 2.511103 0.019936 1.479520
H -7.817256 0.095339 1.302858
H -7.794920 1.374224 0.070972
H 3.791686 -1.460184 -0.135763
H 3.856959 -0.141363 -1.317158
H -9.061724 -0.136321 -1.519765
H -9.084181 -1.414535 -0.288991
H 5.105793 0.018633 1.522069
H -10.433702 0.093439 1.259881
H -11.277317 -0.152152 -0.296655
H -10.411621 1.378957 0.020859
H 9.249516 -1.293372 1.251909
H 9.069322 -0.609706 -0.421583
H 8.454785 -2.262793 -0.064964


