%chk=000261186.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261186

0 1
Br -6.014156 -0.017884 -0.449726
O 2.188122 -1.069967 -0.002486
O 0.705229 1.427506 2.110305
O 2.022428 2.760610 -1.511511
O 2.629475 -2.991401 1.158153
N 0.864659 1.304643 -0.168679
C -1.306167 0.059413 -0.181799
C 0.129335 0.054491 -0.107058
C -1.996974 -1.179760 -0.107090
C 0.798542 -1.156647 0.032086
C -1.263620 -2.399130 0.051051
C -2.061449 1.267703 -0.327209
C 0.105016 -2.396007 0.116487
C -3.426582 -1.194238 -0.187157
C -3.431189 1.237037 -0.401496
C -4.107007 -0.013762 -0.333060
C 1.111828 1.963339 1.105658
C 1.374754 1.736407 -1.439117
C 1.836822 3.262271 1.065906
C 1.054276 0.872253 -2.617206
C 3.035065 -1.991940 0.635168
C 4.414964 -1.464010 0.485540
H -1.817432 -3.337567 0.122308
H -1.529691 2.219753 -0.367216
H 0.673745 -3.320870 0.254595
H -3.946422 -2.152325 -0.126771
H -4.008646 2.157588 -0.507501
H 2.846539 3.164072 0.627686
H 1.332215 4.008072 0.427522
H 1.938411 3.685558 2.076236
H -0.027293 0.716141 -2.748136
H 1.435575 1.331221 -3.543805
H 1.516668 -0.124296 -2.529749
H 4.466149 -0.574199 -0.165291
H 5.087714 -2.230406 0.067068
H 4.825095 -1.171972 1.468394


%chk=000261186-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261186

0 1
Br -6.109945 -0.008456 -0.512344
O 2.205343 -0.997485 0.158838
O 0.748364 1.353116 2.129271
O 1.941797 2.843280 -1.610759
O 2.831422 -3.206672 0.716085
N 0.848989 1.306453 -0.192127
C -1.325140 0.068912 -0.192578
C 0.105301 0.060243 -0.105716
C -2.037889 -1.186998 -0.095175
C 0.794380 -1.145941 0.096144
C -1.295375 -2.394488 0.101917
C -2.076515 1.276751 -0.373704
C 0.095494 -2.389516 0.200817
C -3.468505 -1.197023 -0.191876
C -3.468842 1.250485 -0.464729
C -4.153104 0.000323 -0.375198
C 1.158205 1.920275 1.084298
C 1.296445 1.770684 -1.471126
C 1.950447 3.208946 1.117235
C 0.943308 0.886549 -2.659683
C 3.134837 -2.019996 0.497173
C 4.516089 -1.411989 0.546430
H -1.836325 -3.343924 0.181984
H -1.550428 2.234678 -0.430741
H 0.653082 -3.311355 0.364752
H -4.005463 -2.147703 -0.117871
H -4.037101 2.175152 -0.598017
H 2.941667 3.084963 0.649672
H 1.452265 4.008521 0.544457
H 2.056978 3.500637 2.173398
H -0.147747 0.750238 -2.758756
H 1.333785 1.371687 -3.566094
H 1.394231 -0.116103 -2.557966
H 4.723574 -0.844240 -0.376075
H 5.263633 -2.206709 0.680285
H 4.578740 -0.701594 1.389878


