%chk=000198433.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198433

0 1
Br 1.153203 -2.523629 0.355491
O -2.323480 0.804921 0.145762
O -4.586509 0.918311 -0.074362
N -3.472624 -1.145103 0.134058
C -1.286935 -0.236446 0.259018
C -0.348029 -0.029532 -0.931279
C -2.063691 -1.580272 0.260358
C 1.063140 0.234708 -0.496128
C -3.598175 0.243995 0.050104
C 1.862227 -0.764863 0.078275
C 1.620857 1.513380 -0.662952
C 3.180053 -0.519908 0.468945
C 2.937450 1.771878 -0.275114
C 3.718578 0.757465 0.288280
H -0.800295 -0.024415 1.234687
H -0.742177 0.825115 -1.534443
H -0.376843 -0.891674 -1.632256
H -1.772714 -2.246192 -0.579426
H -1.902375 -2.143750 1.204039
H -4.235235 -1.799625 0.068265
H 1.016467 2.312633 -1.094734
H 3.787910 -1.311248 0.911021
H 3.356312 2.769395 -0.411190
H 4.745985 0.960053 0.588779


%chk=000198433-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198433

0 1
Br 2.036944 -2.760745 0.453704
O -1.707884 0.695503 0.325686
O -3.790503 1.708616 0.756056
N -3.573821 -0.599723 0.229374
C -1.237907 -0.714935 0.129431
C -0.139779 -0.737674 -0.946310
C -2.526536 -1.505794 -0.254379
C 1.156810 -0.095361 -0.484853
C -3.128599 0.696123 0.470417
C 2.207406 -0.812941 0.139659
C 1.348123 1.303657 -0.648781
C 3.400473 -0.197473 0.571000
C 2.529166 1.945410 -0.222813
C 3.560464 1.193895 0.384406
H -0.843443 -1.055622 1.103768
H -0.529520 -0.211532 -1.836881
H 0.032712 -1.793181 -1.228270
H -2.590473 -1.665026 -1.350649
H -2.554636 -2.487758 0.248165
H -4.569030 -0.810472 0.217349
H 0.538068 1.885544 -1.101210
H 4.188236 -0.790584 1.043932
H 2.642756 3.025687 -0.360094
H 4.484074 1.679583 0.716493