%chk=000233083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233083

0 1
Br -5.808684 -0.576592 0.657848
S 0.049314 2.030898 0.294039
O 1.517762 -1.944595 0.857428
O -0.078545 3.465870 0.103456
O 0.837093 1.525528 1.395205
N 0.640458 1.429640 -1.218679
C 1.289366 0.087691 -1.297835
C 0.247576 -0.972434 -1.012514
C 2.500672 -0.064655 -0.400828
C 0.411843 -1.907434 0.019087
C 2.545655 -1.030586 0.613319
C 1.260261 2.447845 -2.104890
C -0.911848 -1.069257 -1.799881
C 3.631327 0.753904 -0.554561
C -1.539960 1.336171 0.396052
C -0.537005 -2.906796 0.296605
C 3.646473 -1.198314 1.468798
C -1.866598 -2.053352 -1.544640
C 4.740864 0.608616 0.277555
C -1.679063 -2.967937 -0.496721
C 4.744541 -0.361079 1.292219
C -1.789943 0.321749 1.324548
C -2.560952 1.802280 -0.436129
C -3.064769 -0.248575 1.414098
C -3.839778 1.239466 -0.359575
C -4.068714 0.215683 0.562523
H 1.634695 -0.054559 -2.365588
H 1.125364 2.150397 -3.158309
H 0.761772 3.430205 -1.973550
H 2.339912 2.594493 -1.917304
H -1.064007 -0.354123 -2.610485
H 3.632646 1.523763 -1.330798
H -0.360651 -3.607227 1.110025
H 3.617584 -1.957064 2.247538
H -2.763348 -2.113441 -2.158204
H 5.605384 1.256376 0.148311
H -2.432279 -3.732679 -0.303991
H 5.611216 -0.459211 1.946087
H -0.987163 -0.032682 1.985743
H -2.369965 2.612609 -1.147366
H -3.259130 -1.042748 2.136161
H -4.637876 1.600755 -1.008895


%chk=000233083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233083

0 1
Br -6.615906 0.583475 0.134987
S -0.118462 1.703823 0.538675
O 1.839050 -1.837567 1.058511
O 0.032806 3.326523 0.655657
O 0.464088 0.713294 1.692883
N 0.538708 1.228299 -1.230352
C 1.346092 -0.068722 -1.272788
C 0.452088 -1.242746 -0.904168
C 2.669166 -0.107940 -0.512911
C 0.722598 -2.041342 0.234536
C 2.826047 -0.927219 0.633865
C 1.207176 2.428197 -1.808479
C -0.678573 -1.568902 -1.692117
C 3.793417 0.652465 -0.926882
C -1.967540 1.358650 0.385862
C -0.119220 -3.116020 0.600415
C 4.011611 -0.927570 1.396255
C -1.521167 -2.646507 -1.353487
C 4.992902 0.657993 -0.185727
C -1.240415 -3.417769 -0.196482
C 5.092725 -0.121291 0.992654
C -2.454836 0.115263 0.813731
C -2.787135 2.391902 -0.094571
C -3.847532 -0.113631 0.740495
C -4.178967 2.159314 -0.170342
C -4.685624 0.907365 0.242842
H 1.561508 -0.119198 -2.362420
H 1.450802 2.177758 -2.858185
H 0.500383 3.271923 -1.801803
H 2.127368 2.747720 -1.283791
H -0.901422 -0.945418 -2.565474
H 3.731309 1.238726 -1.850314
H 0.130380 -3.699417 1.491489
H 4.067238 -1.566753 2.282112
H -2.389447 -2.882269 -1.976973
H 5.842774 1.259685 -0.523352
H -1.888628 -4.257553 0.076584
H 6.015821 -0.116114 1.581773
H -1.777602 -0.648874 1.207226
H -2.357592 3.359261 -0.372701
H -4.264065 -1.070738 1.064958
H -4.850427 2.940523 -0.536290


