%chk=000262017.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262017

0 1
Br -2.494336 2.251808 2.147863
O 2.207651 -0.100694 1.036428
O 1.952038 -1.920378 -0.289425
N -2.241940 -1.224089 -0.122750
N 0.437356 2.711599 -0.533725
C -0.360189 0.706640 0.964972
C 0.035121 -0.605050 0.330817
C -0.877051 -1.462816 -0.213891
C -1.856294 0.782675 1.136239
C -2.721029 -0.101765 0.598332
C 1.454418 -0.973254 0.285976
C -3.218487 -2.128159 -0.767272
C 0.083823 1.831340 0.123346
C 3.663622 -0.264804 1.012941
C 4.216654 0.368833 -0.245469
H 0.156022 0.798550 1.969801
H -0.556201 -2.386787 -0.723479
H -3.809596 -0.021110 0.698139
H -3.900423 -2.569133 -0.017182
H -2.714097 -2.959576 -1.290099
H -3.822937 -1.582830 -1.515898
H 3.945001 0.274733 1.935539
H 3.901166 -1.340470 1.092857
H 5.308850 0.449924 -0.210736
H 3.954745 -0.218192 -1.137968
H 3.810013 1.379203 -0.397853


%chk=000262017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262017

0 1
Br -2.624530 2.107205 2.416779
O 2.223019 -0.000719 0.999004
O 1.915073 -2.020954 -0.155577
N -2.261201 -1.224952 -0.144054
N 0.230418 2.789921 -0.694432
C -0.403533 0.773852 0.967728
C 0.019898 -0.580299 0.375355
C -0.896136 -1.436177 -0.198813
C -1.905967 0.737654 1.227138
C -2.748307 -0.166118 0.652738
C 1.438154 -0.970124 0.354246
C -3.218349 -2.100699 -0.845792
C -0.045377 1.902554 0.053977
C 3.698471 -0.232284 1.000132
C 4.328607 0.314332 -0.283942
H 0.150059 0.954421 1.908860
H -0.545491 -2.350292 -0.686809
H -3.828678 -0.140446 0.810618
H -3.991941 -2.467052 -0.147148
H -2.682134 -2.969921 -1.257478
H -3.710316 -1.565967 -1.678479
H 4.045337 0.308860 1.895142
H 3.882917 -1.315428 1.111139
H 5.429645 0.227384 -0.225274
H 3.983669 -0.256410 -1.162191
H 4.070595 1.377856 -0.425365


