%chk=000264100.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264100

0 1
Br -4.494437 -2.658137 -0.002575
S 0.992968 1.625354 0.003450
O 1.180053 2.324823 1.265894
O 1.177410 2.331795 -1.255482
C -0.610712 0.946275 0.003275
C 2.030291 0.229523 -0.001485
C -1.259273 0.689035 -1.206954
C -1.257096 0.683300 1.213413
C -3.194172 -0.127961 0.003045
C -2.546648 0.147629 -1.212618
C -2.544480 0.141861 1.218820
C 2.454759 -0.318909 -1.214485
C 2.458047 -0.324952 1.207625
C -4.575363 -0.694403 0.002919
C 3.287228 -1.442519 -1.220313
C 3.290517 -1.448559 1.205592
C 3.701311 -2.008138 -0.009327
H -0.765213 0.923735 -2.156628
H -0.761328 0.913474 2.163314
H -3.043483 -0.063134 -2.158676
H -3.039594 -0.073366 2.164774
H 2.148989 0.137362 -2.161938
H 2.154819 0.126603 2.158157
H -5.160022 -0.396532 -0.888066
H -5.158191 -0.401455 0.896729
H 3.617140 -1.871554 -2.164980
H 3.622998 -1.882306 2.147202
H 4.350483 -2.884445 -0.012383


%chk=000264100-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264100

0 1
Br -4.818726 -2.665333 -0.001025
S 1.005666 1.615597 0.003605
O 1.193213 2.361463 1.450132
O 1.190212 2.369845 -1.438957
C -0.749789 0.887340 0.003371
C 2.178308 0.119611 -0.001904
C -1.374681 0.670763 -1.234388
C -1.372799 0.665603 1.241159
C -3.359862 -0.091896 0.003303
C -2.694187 0.170788 -1.224104
C -2.692334 0.165698 1.230781
C 2.607009 -0.373131 -1.243839
C 2.610079 -0.379840 1.236281
C -4.768124 -0.603527 0.003294
C 3.505700 -1.465823 -1.237351
C 3.508756 -1.472466 1.221652
C 3.947035 -2.014909 -0.009869
H -0.854986 0.916437 -2.166236
H -0.851623 0.907351 2.173210
H -3.211435 -0.016775 -2.171808
H -3.208154 -0.025830 2.178471
H 2.273643 0.099202 -2.173801
H 2.278983 0.087428 2.169607
H -5.332438 -0.334818 -0.900755
H -5.331068 -0.338642 0.909324
H 3.864376 -1.879179 -2.185664
H 3.869781 -1.890937 2.166825
H 4.644444 -2.859622 -0.013015


