%chk=000190654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190654

0 1
Br 0.963682 2.761936 -0.802116
O -1.414919 -0.466638 0.411607
O 0.785950 -1.696409 -0.009244
O 0.954447 -2.470614 -2.166227
N -0.912751 1.445503 -0.793841
N 0.750011 -3.921037 -0.323410
C 0.898155 -0.326918 -0.490423
C -0.471639 0.274008 -0.347769
C 1.958876 0.358659 0.346860
C -2.550993 0.349610 0.412281
C -2.258288 1.535451 -0.329780
C 2.166562 1.747518 0.264263
C 2.791332 -0.396414 1.184072
C -3.781339 0.102434 1.013892
C -3.239726 2.521737 -0.472509
C 3.184562 2.371763 0.984372
C 3.813375 0.222413 1.909993
C 4.013743 1.601821 1.807843
C -4.740977 1.101976 0.852908
C -4.475700 2.283660 0.126368
C 0.811680 -2.702586 -0.986947
C 0.419865 -5.128933 -1.112300
H 1.198738 -0.330242 -1.581283
H 2.633125 -1.475042 1.266290
H -3.973115 -0.808283 1.572164
H -3.033726 3.432209 -1.031807
H 3.333954 3.449736 0.909618
H 4.455319 -0.375492 2.556136
H 4.813799 2.082097 2.370444
H -5.726557 0.971004 1.300730
H -5.265740 3.028900 0.034530
H 0.472421 -3.928097 0.658470
H -0.663675 -5.332385 -1.140043
H 0.939536 -5.996592 -0.669223
H 0.773614 -5.020953 -2.157219


%chk=000190654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190654

0 1
Br 2.077033 2.326624 -1.668914
O -1.121448 0.533005 1.057489
O 0.394560 -1.807025 -0.321872
O 1.754932 -2.232696 -2.218513
N -1.666779 0.630218 -1.196038
N 0.802439 -3.957308 -0.927699
C 0.585064 -0.347845 -0.558507
C -0.748770 0.288033 -0.308876
C 1.705398 0.188258 0.329366
C -2.416850 1.082211 0.950908
C -2.751738 1.142828 -0.432587
C 2.458184 1.337673 -0.010875
C 2.014597 -0.463602 1.549694
C -3.267216 1.512490 1.976673
C -4.001611 1.657564 -0.835098
C 3.493955 1.822354 0.814458
C 3.044533 0.005955 2.389524
C 3.788099 1.149917 2.021324
C -4.518431 2.025235 1.559193
C -4.878010 2.095835 0.181880
C 1.061238 -2.651369 -1.261194
C 1.335424 -5.079025 -1.706396
H 0.831547 -0.199889 -1.625420
H 1.433699 -1.350345 1.819590
H -2.984007 1.457913 3.030880
H -4.270782 1.710471 -1.893563
H 4.061134 2.709283 0.517895
H 3.265898 -0.516288 3.326196
H 4.593330 1.522710 2.663247
H -5.228147 2.377879 2.315134
H -5.858022 2.501417 -0.090512
H 0.192683 -4.125453 -0.127235
H 0.521811 -5.678153 -2.155227
H 1.963912 -5.737705 -1.079432
H 1.955941 -4.665370 -2.516796


