%chk=000281447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281447

0 1
Br 5.406060 -0.538554 0.002159
S -3.365546 -0.104639 0.001633
O -3.655530 0.541417 1.259060
O -3.645991 0.523177 -1.267213
O -1.096897 1.647438 -0.004520
C -1.660165 -0.649741 0.011837
C -0.696843 0.506800 0.002813
C 0.767296 0.192067 0.003230
C -4.201685 -1.653946 0.009727
C 1.275062 -1.114422 0.016135
C 1.655393 1.281876 -0.009914
C 2.655185 -1.335334 0.015877
C 3.036726 1.072501 -0.010354
C 3.519771 -0.237359 0.002577
H -1.457881 -1.300775 -0.862176
H -1.462555 -1.282201 0.900507
H -4.002741 -2.262373 0.898361
H -5.295915 -1.517532 0.005099
H -3.996840 -2.274824 -0.868891
H 0.604742 -1.973589 0.026648
H 1.251100 2.301829 -0.019821
H 3.046496 -2.353823 0.025978
H 3.719558 1.924506 -0.020651


%chk=000281447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281447

0 1
Br 5.534179 -0.545371 0.002433
S -3.472924 -0.090751 0.000868
O -3.815518 0.616581 1.427309
O -3.803504 0.593164 -1.439776
O -1.080886 1.699777 -0.006431
C -1.603175 -0.678431 0.013462
C -0.646511 0.518098 0.002412
C 0.821610 0.214298 0.002612
C -4.366965 -1.801054 0.011106
C 1.337457 -1.109136 0.014374
C 1.728150 1.309729 -0.009162
C 2.728539 -1.340061 0.014443
C 3.118534 1.094477 -0.009324
C 3.604272 -0.233051 0.002536
H -1.507349 -1.305890 -0.888774
H -1.513209 -1.283797 0.931299
H -4.077758 -2.319790 0.935661
H -5.434997 -1.542700 0.005245
H -4.071122 -2.334337 -0.903010
H 0.665404 -1.973881 0.023799
H 1.317957 2.324786 -0.018097
H 3.123976 -2.359282 0.023584
H 3.812640 1.939120 -0.018467


