%chk=000274961.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274961

0 1
Br -3.469151 -2.423524 -0.132392
O 2.738522 2.867946 0.148031
O -4.557221 0.459756 -1.100183
O -4.574398 0.364919 1.067222
N 0.644055 2.032791 0.095601
N -4.025563 0.344722 -0.015151
C 0.207603 -0.372366 -0.013290
C 1.652240 -0.624101 -0.012914
C -0.266580 0.967302 0.041785
C 2.546442 0.465896 0.041709
C -0.728733 -1.427608 -0.067052
C 2.064738 1.858548 0.098825
C -1.661062 1.251338 0.043372
C 2.182825 -1.930046 -0.065730
C -2.532763 0.184565 -0.010380
C 3.938850 0.249895 0.043174
C -2.083690 -1.146223 -0.065349
C 3.559092 -2.134177 -0.063846
C 4.443162 -1.044002 -0.009358
H 0.289736 2.994615 0.135082
H -0.379843 -2.465067 -0.109911
H -2.020828 2.280238 0.085844
H 1.510788 -2.788349 -0.108437
H 4.609354 1.115131 0.086184
H 3.958040 -3.149609 -0.105006
H 5.519385 -1.215489 -0.008431


%chk=000274961-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274961

0 1
Br -3.315253 -2.772344 -0.162895
O 2.758318 2.886143 0.291372
O -4.876105 -0.226298 -0.653555
O -4.333854 1.657369 0.512792
N 0.625297 1.980474 0.182508
N -4.029957 0.534211 -0.054101
C 0.195599 -0.421043 -0.021672
C 1.648989 -0.656364 -0.026058
C -0.286500 0.924065 0.081557
C 2.535757 0.463880 0.080231
C -0.764071 -1.461484 -0.106014
C 2.026694 1.856854 0.192888
C -1.672473 1.185653 0.083709
C 2.221722 -1.956167 -0.135178
C -2.599209 0.131933 -0.029982
C 3.940353 0.277278 0.079264
C -2.148153 -1.214815 -0.118903
C 3.616027 -2.132068 -0.135751
C 4.483888 -1.013735 -0.027534
H 0.275154 2.940554 0.260087
H -0.431770 -2.500596 -0.159004
H -2.062190 2.204202 0.174845
H 1.580241 -2.838138 -0.222737
H 4.573289 1.166485 0.163158
H 4.034205 -3.140676 -0.221215
H 5.569002 -1.158269 -0.028411