%chk=000198556.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198556

0 1
Br 5.301685 -0.153351 -1.159496
O -2.804308 -1.101786 0.516498
O 2.967921 1.435942 -0.016388
O -1.874918 2.443832 -1.255481
N -3.394477 1.520474 0.141545
C 1.201613 -0.135475 0.012234
C -1.160403 0.485930 -0.104149
C 0.196891 0.803944 -0.267163
C -1.476540 -0.804761 0.358268
C 0.851598 -1.414188 0.474251
C -0.484884 -1.759382 0.650011
C 2.622081 0.291934 -0.171821
C -2.148994 1.543925 -0.475308
C 3.570968 -0.819704 -0.580339
H 0.469752 1.810310 -0.626328
H 1.625659 -2.148158 0.708997
H -0.756454 -2.747900 1.009384
H 3.754832 -1.508158 0.266049
H 3.152167 -1.411278 -1.417187
H -2.954616 -2.037326 0.812430
H -3.717096 0.749024 0.703749
H -4.089078 2.199151 -0.134652


%chk=000198556-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198556

0 1
Br 5.509539 -0.228904 -0.837201
O -2.848812 -1.091133 0.705089
O 2.871663 1.411277 -0.919474
O -1.757985 2.821216 -0.617051
N -3.494861 1.439734 0.056311
C 1.186744 -0.155194 -0.194503
C -1.189374 0.537521 -0.031957
C 0.163017 0.816578 -0.323991
C -1.509156 -0.780044 0.407088
C 0.833628 -1.460167 0.246797
C -0.504159 -1.768014 0.544373
C 2.596126 0.248006 -0.531432
C -2.166785 1.686526 -0.220143
C 3.667042 -0.845484 -0.370765
H 0.411875 1.828568 -0.661987
H 1.588803 -2.243908 0.363139
H -0.771989 -2.776925 0.884269
H 3.717920 -1.194152 0.674454
H 3.456528 -1.702484 -1.032321
H -2.949677 -2.029542 0.998843
H -3.806178 0.519672 0.375183
H -4.150511 2.209852 -0.069618