%chk=000202960.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202960

0 1
Br -0.421708 0.086811 1.973511
O 1.092113 1.794420 -0.216810
O -2.241226 -1.555443 -0.021374
O -2.827161 0.530462 -0.035098
N 1.725094 -0.496468 0.119312
N -1.999756 -0.362298 -0.003723
C -0.545420 0.052186 0.041877
C 0.449786 -0.989453 -0.485141
C -0.241628 1.424268 -0.582704
C 2.109930 0.812762 -0.499849
C 2.822511 -1.494627 0.006564
H 0.210545 -2.011774 -0.106184
H 0.437930 -1.047009 -1.592973
H -0.349661 1.403017 -1.681720
H -0.853650 2.245591 -0.151899
H 2.981739 1.241975 0.040049
H 2.275650 0.779447 -1.594063
H 2.522118 -2.417121 0.534947
H 3.711327 -1.109014 0.536051
H 3.111668 -1.759832 -1.020774


%chk=000202960-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202960

0 1
Br -0.701408 0.148877 2.213729
O 1.167683 1.821944 -0.065021
O -2.211388 -1.608372 -0.414304
O -2.813027 0.588587 -0.548580
N 1.822733 -0.494879 0.067704
N -1.975950 -0.352242 -0.294561
C -0.560597 0.072762 0.197574
C 0.473913 -0.986989 -0.236648
C -0.214229 1.470743 -0.371916
C 2.090040 0.796001 -0.568846
C 2.891190 -1.500392 -0.054933
H 0.284601 -1.937591 0.284077
H 0.314873 -1.166924 -1.334257
H -0.376041 1.433332 -1.473968
H -0.845361 2.256246 0.061734
H 3.100357 1.142577 -0.304509
H 1.978674 0.751245 -1.687790
H 2.664258 -2.359259 0.600470
H 3.846542 -1.062239 0.283676
H 3.033338 -1.885526 -1.093631


