%chk=000240381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240381

0 1
Br -5.391418 -3.575016 -0.556796
Br -4.151673 4.021517 0.888693
O 7.287103 -0.468305 -0.368663
O 6.786352 1.291433 0.782093
N -3.241457 0.003263 0.014402
N 6.481687 0.299253 0.137237
C 0.401693 0.511667 0.316803
C 1.550673 1.339890 0.848073
C 0.900491 -0.609230 -0.416318
C 2.765287 0.591881 0.352667
C 2.358502 -0.565202 -0.397765
C -1.861207 -0.190246 -0.122894
C -0.951278 0.733206 0.470264
C -4.219066 -0.971960 -0.521332
C -3.794058 1.194384 0.699460
C 0.008660 -1.507684 -0.994769
C -1.363044 -1.303020 -0.850515
C 4.099231 0.884823 0.534366
C 3.306344 -1.414953 -0.957286
C -4.369213 -2.172934 0.432637
C -3.787450 2.415121 -0.241208
C 5.048264 0.008014 -0.042785
C 4.664819 -1.122208 -0.775924
C -5.093403 -1.849341 1.719239
C -4.816362 2.344400 -1.346071
H 1.520848 2.379650 0.466769
H 1.531365 1.411882 1.953358
H -1.304030 1.587309 1.040310
H -3.886995 -1.313684 -1.533536
H -5.203848 -0.474488 -0.677650
H -3.196115 1.404134 1.621170
H -4.829367 0.982208 1.052897
H 0.376159 -2.366260 -1.557859
H -2.045914 -2.008911 -1.317232
H 4.437142 1.757392 1.100054
H -3.377803 -2.639506 0.641822
H -2.767905 2.588332 -0.659214
H 3.005485 -2.292173 -1.526190
H 5.433794 -1.774278 -1.205581
H -6.095648 -1.432974 1.551136
H -5.226281 -2.741936 2.349778
H -4.525374 -1.122364 2.318513
H -5.840419 2.223883 -0.967935
H -4.815818 3.254764 -1.965094
H -4.609051 1.502866 -2.023725


%chk=000240381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240381

0 1
Br -5.532467 -3.591441 -0.606970
Br -4.284876 4.074548 0.946981
O 7.366706 -0.517015 -0.409866
O 6.845363 1.359321 0.782210
N -3.309272 0.010699 0.025288
N 6.509978 0.299831 0.115699
C 0.390463 0.524278 0.321298
C 1.549262 1.368615 0.841202
C 0.895218 -0.604517 -0.394861
C 2.772711 0.605152 0.347375
C 2.359272 -0.559169 -0.381918
C -1.916892 -0.184588 -0.106029
C -0.984056 0.742849 0.465732
C -4.268385 -0.974373 -0.512697
C -3.844450 1.209177 0.700449
C -0.014559 -1.523378 -0.964658
C -1.397503 -1.318101 -0.818302
C 4.128224 0.900076 0.519755
C 3.323041 -1.432540 -0.943254
C -4.399777 -2.211397 0.412317
C -3.799211 2.454115 -0.222159
C 5.074378 0.010209 -0.051964
C 4.690554 -1.145069 -0.776929
C -5.044578 -1.935525 1.771312
C -4.742407 2.400836 -1.424740
H 1.520976 2.401838 0.443742
H 1.536684 1.455368 1.945092
H -1.329859 1.621814 1.017733
H -3.973294 -1.295462 -1.527961
H -5.257950 -0.495403 -0.607353
H -3.289336 1.414874 1.633621
H -4.892000 1.019827 0.990507
H 0.340386 -2.398844 -1.519511
H -2.077371 -2.046407 -1.268156
H 4.482802 1.776299 1.069229
H -3.430904 -2.724396 0.523004
H -2.765460 2.677200 -0.531015
H 3.016772 -2.323075 -1.501656
H 5.470236 -1.788922 -1.191919
H -6.061176 -1.519363 1.658932
H -5.112994 -2.857521 2.371513
H -4.421735 -1.210951 2.331219
H -5.793184 2.279030 -1.107988
H -4.666966 3.320019 -2.028227
H -4.462665 1.546082 -2.070679


