%chk=000269133.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269133

0 1
Br -6.871978 -1.598962 -1.755992
O 3.763030 -0.855479 1.800952
O 4.972771 -0.022671 -2.064902
N 2.893349 -0.369347 -0.284666
C -2.339908 1.590909 1.033242
C -0.966389 1.067018 0.709449
C -3.429756 0.816822 0.340441
C -0.500372 1.089538 -0.615897
C -0.136479 0.565704 1.720953
C 1.601024 0.118133 0.099129
C 0.772945 0.621621 -0.927672
C 1.143178 0.092813 1.426283
C -3.485841 -0.582048 0.459108
C -4.406854 1.488044 -0.409971
C 3.888862 -0.812703 0.591808
C -4.505919 -1.304361 -0.162848
C -5.433255 0.773224 -1.035251
C 5.167452 -1.310761 -0.070455
C -5.470180 -0.615515 -0.903239
C 5.705678 -0.471601 -1.209478
C 7.185058 -0.261265 -1.223869
H -2.526298 1.563658 2.130451
H -2.386052 2.670312 0.767902
H -1.143834 1.472099 -1.408592
H -0.484274 0.541455 2.753563
H 1.120546 0.647680 -1.958943
H 1.783200 -0.291481 2.228137
H -2.722065 -1.106992 1.034101
H -4.372789 2.571713 -0.511102
H 3.124620 -0.289334 -1.292855
H 4.989697 -2.347165 -0.442061
H 5.924405 -1.437161 0.738647
H -4.543289 -2.390399 -0.068766
H -6.190185 1.300839 -1.616651
H 7.512106 0.363175 -0.377897
H 7.506923 0.255582 -2.143300
H 7.747475 -1.202896 -1.164659


%chk=000269133-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269133

0 1
Br -7.073916 -1.379995 -2.073908
O 3.980923 -0.679354 2.071273
O 4.809751 -0.275320 -2.125679
N 3.014578 -0.306194 -0.047410
C -2.394981 1.472458 1.087796
C -0.980211 0.973200 0.803940
C -3.503267 0.782261 0.293546
C -0.485288 0.887564 -0.523942
C -0.107662 0.615681 1.859828
C 1.697656 0.114785 0.291557
C 0.831790 0.467342 -0.780311
C 1.217756 0.190199 1.625173
C -3.547244 -0.630900 0.175533
C -4.537555 1.538119 -0.311047
C 4.041552 -0.662983 0.804364
C -4.594418 -1.276525 -0.517682
C -5.595451 0.912830 -1.011643
C 5.347104 -1.125102 0.108046
C -5.609835 -0.492332 -1.103495
C 5.699781 -0.563097 -1.270413
C 7.173109 -0.377990 -1.574573
H -2.598629 1.350302 2.170507
H -2.449041 2.561858 0.890226
H -1.140608 1.148089 -1.363308
H -0.466873 0.670587 2.895196
H 1.196793 0.411339 -1.813506
H 1.880386 -0.078962 2.449576
H -2.750457 -1.235129 0.623983
H -4.524088 2.632431 -0.238434
H 3.271691 -0.301988 -1.051395
H 5.274123 -2.228760 -0.004606
H 6.167923 -0.948742 0.822894
H -4.617496 -2.367059 -0.599640
H -6.386159 1.509959 -1.474723
H 7.569183 0.465892 -0.976262
H 7.322516 -0.161248 -2.643095
H 7.753164 -1.273022 -1.283266


