%chk=000254690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254690

0 1
Br -0.426403 -3.509886 1.970669
O 2.160692 -0.766102 1.097812
O 2.630904 -2.171374 -1.838529
O 2.212987 1.297592 -1.603896
O 3.037507 2.130575 2.120926
O -4.366212 0.644535 0.660906
O -1.261339 2.908889 -1.846150
N -0.047658 -1.192588 0.361205
N -0.518731 1.001562 -0.829587
N -2.161814 -1.468766 1.261584
N -2.817660 1.748033 -0.578525
C 1.380488 -1.486172 0.142331
C 1.912498 -1.096954 -1.266875
C 2.826476 0.140645 -1.029242
C 2.875860 0.355158 0.501744
C 2.265708 1.668277 1.014040
C -0.830581 -0.088755 -0.034149
C -0.943266 -1.970921 1.170582
C -2.128777 -0.283128 0.511473
C -3.224849 0.640239 0.281000
C -1.544345 1.968682 -1.133999
H 1.571822 -2.567868 0.382650
H 1.112711 -0.908508 -2.021796
H 3.834460 -0.003116 -1.472961
H 3.909480 0.233499 0.908577
H 1.207456 1.542981 1.303811
H 2.364680 2.490187 0.270540
H 3.374510 -2.468057 -1.262399
H 2.424014 1.369260 -2.565628
H 0.441916 1.193636 -1.179702
H 2.828955 1.606262 2.926797
H -3.540286 2.451184 -0.804308


%chk=000254690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254690

0 1
Br -0.403595 -3.725387 1.787601
O 1.788882 -0.084547 1.095547
O 2.658385 -2.209334 -1.506986
O 1.859512 1.432428 -1.472884
O 3.734340 1.709215 2.358686
O -4.735080 0.188010 0.295733
O -1.546677 3.014271 -1.673628
N -0.224141 -1.143766 0.391870
N -0.760831 1.051768 -0.672978
N -2.356379 -1.747297 1.000569
N -3.081246 1.548926 -0.658439
C 1.227129 -1.190580 0.295586
C 1.844428 -1.050727 -1.149797
C 2.680991 0.266757 -1.090607
C 3.023050 0.395751 0.404468
C 3.334868 1.789898 0.953970
C -1.079996 -0.115798 -0.018746
C -1.084631 -2.099947 1.021960
C -2.380420 -0.498826 0.349467
C -3.517040 0.360989 0.041930
C -1.788216 1.948558 -1.044587
H 1.533396 -2.168132 0.716816
H 1.071636 -1.013509 -1.932455
H 3.574224 0.191477 -1.735622
H 3.864555 -0.286194 0.658653
H 2.460901 2.450411 0.803877
H 4.203627 2.218203 0.427080
H 3.376884 -2.352470 -0.837483
H 1.933587 1.624250 -2.439146
H 0.217522 1.322581 -0.919615
H 2.961136 1.382008 2.885562
H -3.829596 2.200012 -0.917504


