%chk=000228569.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228569

0 1
Br -4.876424 -2.166305 -1.014046
Br 4.055991 2.676073 2.027954
Br -3.624215 3.239156 0.408992
Br 1.842804 2.224633 -3.236253
O 3.537365 -4.045141 0.106964
O -5.274254 0.941833 -0.572144
O 3.644559 3.218953 -1.063263
O 1.443359 -4.712123 -0.312710
C -0.006064 -0.715056 0.860383
C 0.426366 -2.054744 0.201867
C -1.422135 -0.317873 0.429378
C 0.981182 0.362825 0.410643
C -0.056425 -0.884654 2.389565
C 1.880529 -2.426161 0.499182
C -1.823204 1.026558 0.563744
C 0.973818 0.759274 -0.943447
C -2.346942 -1.260774 -0.032117
C 1.905589 0.942454 1.284178
C 2.177575 -3.824917 0.050569
C -3.643083 -0.871408 -0.379390
C 2.810767 1.903001 0.822677
C -3.111363 1.423692 0.223938
C 1.870301 1.711198 -1.412426
C -4.038970 0.472640 -0.258355
C 2.803954 2.297768 -0.526404
H -0.239119 -2.875117 0.549225
H 0.278820 -1.999263 -0.896600
H -0.325759 0.051134 2.894454
H 0.898532 -1.229642 2.801132
H -0.814473 -1.625702 2.676496
H 2.103300 -2.338306 1.587242
H 2.585193 -1.714111 0.010008
H -1.110351 1.769411 0.939262
H 0.246120 0.313707 -1.631118
H -2.069117 -2.316119 -0.122265
H 1.933582 0.652825 2.338372
H 3.791500 -4.963300 -0.177984
H -5.889290 0.228469 -0.912153
H 4.279882 3.607511 -0.393748


%chk=000228569-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228569

0 1
Br -4.864218 -2.112865 -1.334153
Br 4.091413 2.858208 1.968660
Br -3.812799 3.198930 0.764095
Br 1.945096 2.090236 -3.373026
O 3.525602 -4.216565 0.293547
O -5.403725 0.906172 -0.524284
O 3.747435 3.233910 -1.165428
O 1.486803 -4.535977 -0.770797
C 0.000751 -0.701257 0.894436
C 0.421011 -2.081822 0.284142
C -1.433639 -0.314315 0.441504
C 0.996076 0.381047 0.406379
C -0.032814 -0.815702 2.447610
C 1.872998 -2.494437 0.585377
C -1.903204 1.000413 0.706099
C 1.024977 0.718459 -0.974082
C -2.324418 -1.231003 -0.166244
C 1.913064 1.024876 1.269576
C 2.219313 -3.830818 -0.042813
C -3.633564 -0.828634 -0.485698
C 2.820924 1.967543 0.753842
C -3.212840 1.384872 0.382513
C 1.939075 1.657861 -1.474227
C -4.120682 0.476524 -0.224031
C 2.867934 2.312320 -0.620228
H -0.253444 -2.868682 0.670390
H 0.285435 -2.061490 -0.813313
H -0.327807 0.139228 2.916877
H 0.943079 -1.117967 2.868028
H -0.777397 -1.575154 2.743381
H 2.070269 -2.576374 1.670493
H 2.594201 -1.746824 0.203928
H -1.231268 1.736364 1.158397
H 0.312948 0.251665 -1.661801
H -2.016160 -2.251926 -0.399095
H 1.928964 0.804348 2.338986
H 3.732644 -5.088776 -0.140351
H -5.922823 0.171480 -0.950163
H 4.330688 3.618527 -0.456724


