%chk=000274843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274843

0 1
Br -7.523440 0.215020 -0.318146
S 1.761680 1.634194 0.672161
O 0.731183 -3.395037 -0.048844
O 0.738400 0.473308 -0.097487
O 1.428460 1.555843 2.064678
O 1.587292 2.858848 -0.064295
C -0.525191 -2.657042 -0.208971
C -0.800028 -1.631485 0.870570
C 0.617246 -2.454976 -1.165833
C -1.425018 -0.396220 0.293023
C -2.848140 -0.263463 0.155758
C -0.625404 0.656201 -0.128099
C -3.389312 0.936744 -0.380449
C -1.158288 1.868255 -0.660651
C -2.515251 1.999372 -0.779323
C -3.750776 -1.306204 0.546168
C -4.807306 1.075119 -0.519564
C -5.108132 -1.161414 0.406724
C -5.627370 0.047097 -0.134615
C 3.247213 0.880153 0.311771
C 4.039191 1.357265 -0.742300
C 3.676829 -0.225926 1.060372
C 5.683275 -0.370873 -0.297927
C 5.250433 0.739451 -1.045492
C 4.885925 -0.847671 0.759542
C 6.972599 -1.046431 -0.615860
H -1.368624 -3.291139 -0.494450
H 0.155403 -1.367704 1.385043
H -1.435420 -2.070824 1.667848
H 0.615693 -2.921928 -2.145810
H 1.248931 -1.569496 -1.077236
H -0.473067 2.668140 -0.963799
H -2.951649 2.914739 -1.181633
H -3.338945 -2.226386 0.963761
H -5.206462 2.003435 -0.931953
H -5.792132 -1.957339 0.705404
H 3.707187 2.222744 -1.329274
H 3.063542 -0.603799 1.886927
H 5.861085 1.116989 -1.864526
H 5.212280 -1.709541 1.341249
H 7.525429 -0.563610 -1.433382
H 7.644285 -1.066280 0.256619
H 6.810792 -2.094629 -0.914897


%chk=000274843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274843

0 1
Br -7.664255 -0.026525 0.195602
S 1.760051 1.755222 0.707165
O 0.727515 -3.436622 0.025217
O 0.633170 0.745408 -0.729498
O 1.169337 1.303467 2.157848
O 1.927242 3.332053 0.339441
C -0.488792 -2.572094 -0.220707
C -0.634596 -1.375318 0.718030
C 0.600976 -2.616253 -1.244740
C -1.424610 -0.239328 0.093103
C -2.863556 -0.205427 0.115018
C -0.730389 0.811047 -0.573893
C -3.568793 0.913784 -0.484526
C -1.437866 1.926796 -1.148419
C -2.822726 1.975191 -1.105342
C -3.646349 -1.245706 0.724473
C -4.997931 0.953053 -0.452571
C -5.041434 -1.195235 0.750182
C -5.706018 -0.084147 0.153244
C 3.371950 0.866502 0.350231
C 4.328258 1.530727 -0.432937
C 3.553287 -0.426257 0.871808
C 5.780100 -0.450932 -0.193309
C 5.541912 0.855369 -0.694180
C 4.772593 -1.076568 0.591912
C 7.082141 -1.173280 -0.483416
H -1.399930 -3.155526 -0.415367
H 0.376881 -1.018172 0.964230
H -1.095988 -1.705191 1.665907
H 0.463578 -3.208336 -2.157605
H 1.286396 -1.763387 -1.313147
H -0.846664 2.715916 -1.623199
H -3.365513 2.817648 -1.547936
H -3.145058 -2.099589 1.189711
H -5.521764 1.800534 -0.905245
H -5.622107 -1.993232 1.220688
H 4.136805 2.540368 -0.809591
H 2.784311 -0.907076 1.484556
H 6.310242 1.352159 -1.296741
H 4.939871 -2.085415 0.985783
H 7.764314 -0.556984 -1.092345
H 7.607940 -1.437547 0.452745
H 6.899870 -2.117599 -1.029382


