%chk=000253128.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253128

0 1
Br -5.581511 -0.237750 -0.530588
S 0.687970 0.861752 0.310494
O 4.023954 -1.232263 -0.392269
O 1.206802 1.439585 -0.916629
O 0.908766 1.536804 1.573240
N 1.327459 -0.739571 0.499194
C 1.623626 -1.464207 -0.768274
C 2.461099 -0.857245 1.459022
C 2.976948 -1.041291 -1.366323
C 3.808812 -0.480587 0.820292
C -1.005964 0.554794 0.088452
C -1.765729 0.024660 1.134250
C -1.604784 0.859522 -1.138119
C -3.133350 -0.214739 0.955723
C -2.969925 0.626218 -1.329547
C -3.715575 0.089083 -0.276604
H 0.802269 -1.311632 -1.498794
H 1.641979 -2.554777 -0.531620
H 2.491929 -1.915407 1.809170
H 2.260749 -0.227176 2.357672
H 3.300504 -1.698597 -2.191497
H 2.972437 0.015931 -1.699645
H 3.883661 0.597966 0.593399
H 4.667973 -0.790366 1.442007
H -1.301063 -0.204277 2.099262
H -1.005940 1.288306 -1.952887
H -3.727758 -0.629185 1.771780
H -3.438638 0.865349 -2.285663


%chk=000253128-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253128

0 1
Br -5.696074 -0.250880 -0.599296
S 0.729736 0.925348 0.358168
O 4.105026 -1.316393 -0.420593
O 1.247457 1.674193 -1.007221
O 0.937495 1.612384 1.821758
N 1.380389 -0.876181 0.573694
C 1.656654 -1.506492 -0.757227
C 2.568010 -0.888774 1.484449
C 3.007807 -1.091245 -1.379624
C 3.889756 -0.504148 0.790538
C -1.097822 0.552839 0.089705
C -1.847201 0.032030 1.157271
C -1.644420 0.862001 -1.165307
C -3.223615 -0.208336 0.948741
C -3.022615 0.621418 -1.370695
C -3.789004 0.086236 -0.313006
H 0.818429 -1.288173 -1.444388
H 1.656326 -2.596267 -0.559650
H 2.624091 -1.927978 1.862828
H 2.355074 -0.217413 2.335810
H 3.245741 -1.721193 -2.252527
H 2.976367 -0.025537 -1.684557
H 3.887050 0.576064 0.528313
H 4.752071 -0.714904 1.444085
H -1.380022 -0.177383 2.123867
H -1.013742 1.294161 -1.949358
H -3.840975 -0.615426 1.753882
H -3.485287 0.850950 -2.334161


