%chk=000287378.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287378

0 1
Br 5.861818 -0.839172 0.445670
O -6.328394 -0.913659 0.934735
N -2.324343 -0.366698 -0.367329
N -0.182018 -1.272825 -0.179867
C 0.981665 1.347419 -0.089355
C -0.419140 1.196692 -0.229693
C 1.819544 0.162979 0.013319
C -0.956713 -0.175818 -0.264374
C 1.195358 -1.113381 -0.035484
C -2.906084 -1.732682 -0.442150
C -4.433162 -1.670976 -0.387329
C 1.528238 2.657664 -0.052911
C -1.239143 2.346170 -0.327583
C 3.227921 0.229163 0.158899
C 1.984547 -2.299459 0.060589
C 0.710733 3.767298 -0.151061
C -0.686440 3.613116 -0.289513
C -4.949312 -1.297379 1.006523
C 3.962920 -0.934773 0.249418
C 3.351708 -2.210151 0.201316
H -2.493774 -2.348264 0.394984
H -2.565499 -2.231782 -1.380987
H -2.940405 0.421217 -0.529650
H -4.833775 -0.948857 -1.129697
H -4.844978 -2.652124 -0.697720
H 2.607463 2.779271 0.054530
H -2.318906 2.234396 -0.432378
H 3.714653 1.206973 0.197729
H 1.477910 -3.264912 0.019566
H 1.136725 4.770764 -0.122094
H -1.318518 4.496295 -0.364427
H -4.830372 -2.121268 1.731196
H -4.465572 -0.385627 1.407565
H 3.963587 -3.111120 0.275726
H -6.888043 -1.673488 0.683735


%chk=000287378-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287378

0 1
Br 5.868771 -0.916659 0.679392
O -6.190359 -1.078005 1.333571
N -2.344195 -0.351412 -0.598280
N -0.230031 -1.264288 -0.259871
C 0.970053 1.358582 -0.097675
C -0.446316 1.205057 -0.300800
C 1.797067 0.157151 0.041061
C -0.988710 -0.164756 -0.387850
C 1.137807 -1.121230 -0.035557
C -2.955916 -1.685181 -0.711712
C -4.464277 -1.626692 -0.392864
C 1.507364 2.678894 -0.027836
C -1.266503 2.366849 -0.404232
C 3.205766 0.195536 0.253120
C 1.908242 -2.314330 0.107126
C 0.685896 3.807721 -0.145612
C -0.714582 3.653692 -0.331057
C -4.756155 -1.288668 1.082661
C 3.924308 -0.996633 0.386436
C 3.292633 -2.265914 0.317362
H -2.420182 -2.356472 -0.017765
H -2.796108 -2.099606 -1.728908
H -2.922452 0.449498 -0.846933
H -4.969509 -0.876129 -1.035008
H -4.911110 -2.608894 -0.646948
H 2.581519 2.821543 0.123077
H -2.351851 2.278592 -0.528974
H 3.736714 1.148670 0.316379
H 1.380312 -3.270272 0.043325
H 1.122760 4.810432 -0.088650
H -1.359639 4.534915 -0.410760
H -4.344789 -2.081483 1.743945
H -4.284960 -0.332867 1.363759
H 3.877056 -3.183991 0.425132
H -6.678424 -1.918649 1.142844


