%chk=000289068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289068

0 1
Br 4.845397 2.937481 2.476998
O 0.069444 -1.618675 1.059210
O 0.268242 -0.717206 -3.476050
N -1.380867 -0.205965 -1.880811
N 0.457117 -1.403926 -1.223044
N 2.885806 -1.190077 -1.591002
C -1.518330 -0.323595 -0.391652
C -0.264473 -1.190529 -0.013049
C -1.459104 1.065619 0.222496
C -2.763280 -1.092071 0.019137
C -0.166671 -0.750247 -2.349825
C 1.773163 -2.108498 -1.315333
C -2.636446 1.824850 0.306719
C -2.968892 -1.323318 1.390566
C -0.245872 1.614010 0.661252
C -3.690657 -1.570145 -0.913572
C -2.598625 3.119392 0.830048
C -4.099981 -2.017933 1.820189
C -0.214063 2.909295 1.186542
C -4.824059 -2.264906 -0.475983
C -1.387884 3.663777 1.271038
C -5.031996 -2.487688 0.887249
C 3.281549 -0.225778 -0.622764
C 2.977855 -0.367720 0.746599
C 4.065058 0.868855 -1.058773
C 3.453714 0.567198 1.665356
C 4.537009 1.798075 -0.135287
C 4.221184 1.645224 1.218579
H -1.847321 0.553507 -2.367457
H 1.935089 -2.651900 -0.347738
H 1.715980 -2.851628 -2.152104
H -3.585636 1.402456 -0.026305
H -2.233944 -0.969115 2.117884
H 0.684625 1.044452 0.607923
H -3.538266 -1.417134 -1.982287
H 2.900414 -0.853362 -2.561785
H -3.515391 3.704148 0.896624
H -4.254737 -2.197094 2.883559
H 0.732445 3.328591 1.530738
H -5.543517 -2.635567 -1.204940
H -1.359792 4.672810 1.680818
H -5.914637 -3.029183 1.224371
H 2.374587 -1.205846 1.104372
H 4.311122 0.985312 -2.112601
H 3.219497 0.449483 2.725934
H 5.145542 2.639372 -0.473239


%chk=000289068-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289068

0 1
Br 5.699114 2.754738 2.292812
O -0.021490 -1.459118 1.208540
O 0.232853 -0.675204 -3.419903
N -1.407142 -0.082947 -1.790395
N 0.372084 -1.284139 -1.117179
N 2.784737 -1.131864 -1.574383
C -1.617235 -0.233387 -0.327713
C -0.340245 -1.060582 0.062787
C -1.627133 1.156605 0.348224
C -2.855186 -1.089725 0.011691
C -0.241861 -0.663281 -2.256259
C 1.675206 -1.994763 -1.239701
C -2.851226 1.854880 0.502989
C -3.204046 -1.283232 1.373149
C -0.417410 1.793906 0.722898
C -3.615361 -1.727039 -0.996698
C -2.865620 3.167746 1.023007
C -4.305951 -2.093947 1.715490
C -0.433440 3.103788 1.248644
C -4.724417 -2.534087 -0.651580
C -1.656576 3.796807 1.398367
C -5.073994 -2.719450 0.704369
C 3.411880 -0.252758 -0.672171
C 3.107033 -0.235937 0.719344
C 4.404557 0.644129 -1.163500
C 3.788783 0.643483 1.589264
C 5.078390 1.527200 -0.298018
C 4.765648 1.519338 1.077877
H -1.955923 0.554099 -2.365867
H 1.832643 -2.509293 -0.276996
H 1.565435 -2.745335 -2.039147
H -3.794156 1.367473 0.230669
H -2.604449 -0.809053 2.156969
H 0.542737 1.275369 0.619503
H -3.338238 -1.600496 -2.048433
H 2.905242 -0.939060 -2.569886
H -3.818495 3.695982 1.138243
H -4.564149 -2.240084 2.770058
H 0.508393 3.580596 1.541384
H -5.309223 -3.018754 -1.441294
H -1.667154 4.813380 1.806671
H -5.931369 -3.346976 0.971961
H 2.339490 -0.892667 1.141759
H 4.654152 0.647554 -2.231484
H 3.546544 0.642136 2.656191
H 5.836967 2.208772 -0.693653


