%chk=000260371.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260371

0 1
Br 6.594588 1.220484 0.924773
O -2.229114 -1.859184 0.128913
O 0.395720 -1.935114 0.421147
O -2.170355 -3.364743 -1.563257
N 0.710726 0.196184 -0.411705
C -1.498684 -0.900967 -0.678012
C -2.185031 0.422323 -0.475580
C -0.048407 -0.959370 -0.140647
C -2.548166 0.836141 0.813648
C -2.462154 1.238064 -1.582508
C 2.086733 0.390333 -0.072037
C -3.179777 2.069510 0.995248
C -3.090077 2.471696 -1.392930
C -3.447582 2.888885 -0.105921
C 2.654809 1.647957 -0.373699
C 2.867252 -0.614498 0.527851
C -2.455587 -3.121808 -0.417715
C 3.995253 1.890295 -0.076224
C 4.207539 -0.363624 0.822330
C 4.760176 0.883318 0.518946
C -3.081081 -3.969592 0.627140
H -1.502977 -1.237767 -1.749440
H -2.345298 0.184402 1.665921
H -2.202683 0.911913 -2.589065
H 0.243287 1.003194 -0.837686
H -3.464530 2.390774 1.996800
H -3.307526 3.107028 -2.250922
H -3.938941 3.850673 0.037363
H 2.059745 2.432751 -0.835773
H 2.429700 -1.591557 0.766351
H 4.436049 2.861495 -0.309197
H 4.813169 -1.144716 1.287615
H -3.480134 -3.379245 1.468659
H -2.335132 -4.666326 1.049903
H -3.899514 -4.576310 0.209112


%chk=000260371-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260371

0 1
Br 6.670848 1.467507 0.819979
O -2.137048 -1.956947 0.294211
O 0.607806 -2.224654 -0.161861
O -2.832583 -3.232887 -1.540531
N 0.693170 0.126567 -0.162082
C -1.465764 -1.005488 -0.630314
C -2.118040 0.359148 -0.518621
C 0.049303 -1.097556 -0.276326
C -2.431241 0.915283 0.750268
C -2.407873 1.101463 -1.691300
C 2.074386 0.377718 0.069317
C -3.020285 2.195139 0.839965
C -2.991298 2.385995 -1.600236
C -3.297595 2.935884 -0.334233
C 2.490864 1.734669 0.132292
C 3.032813 -0.657956 0.233168
C -2.756641 -3.075259 -0.304665
C 3.843161 2.062661 0.353460
C 4.387589 -0.328852 0.453182
C 4.782545 1.022399 0.511633
C -3.267907 -4.010736 0.763741
H -1.576408 -1.407194 -1.657893
H -2.231117 0.331960 1.655432
H -2.188193 0.669212 -2.674965
H 0.090907 0.952190 -0.243898
H -3.266415 2.613949 1.821928
H -3.215359 2.948976 -2.512719
H -3.755943 3.928331 -0.262396
H 1.758806 2.542211 0.007753
H 2.712996 -1.700423 0.189336
H 4.155640 3.109495 0.400184
H 5.124371 -1.127343 0.578439
H -3.720333 -3.446639 1.594867
H -2.417282 -4.585254 1.173092
H -3.995882 -4.710971 0.329198


