%chk=000229958.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229958

0 1
Br -0.121437 3.014104 1.294631
Br -7.181570 -2.520157 1.834116
O 2.792412 -2.510023 -1.903193
O -3.822156 2.487988 -1.513114
N -1.207317 1.012236 -0.143962
C 2.927054 0.402641 0.133947
C 4.340354 -0.030700 0.128267
C 2.167473 -0.515589 -0.653927
C 4.446739 -1.216326 -0.665207
C 3.090894 -1.583054 -1.199057
C 2.320489 1.487143 0.754630
C 0.805922 -0.375219 -0.839178
C 5.457093 0.512969 0.733608
C 5.660689 -1.845892 -0.846743
C 0.188868 0.725364 -0.205477
C 0.941047 1.622439 0.570094
C 6.698808 -0.135191 0.545141
C 6.801079 -1.287666 -0.226384
C -1.952358 1.090689 -1.188944
C -4.295009 0.491988 -0.306041
C -3.415943 1.466654 -1.012934
C -3.905370 -0.112228 0.896366
C -5.556592 0.216127 -0.859256
C -4.766752 -1.007198 1.539559
C -6.417351 -0.684321 -0.228110
C -6.008081 -1.286179 0.965101
H 2.883306 2.197598 1.358744
H 0.233834 -1.085794 -1.436147
H 5.394963 1.413409 1.340340
H 5.741056 -2.750112 -1.451909
H 7.588648 0.283644 1.017784
H 7.768087 -1.772454 -0.359191
H -1.663265 0.975913 -2.245402
H -2.933374 0.120810 1.345506
H -5.865920 0.713787 -1.781832
H -4.463993 -1.475513 2.477847
H -7.394428 -0.904185 -0.661372


%chk=000229958-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229958

0 1
Br -0.383517 1.567868 2.414070
Br -7.808309 -0.355383 2.767544
O 3.318488 -1.575526 -2.871785
O -3.724055 0.277640 -2.838211
N -1.273429 0.215813 -0.240568
C 2.952865 0.121702 0.289809
C 4.422313 -0.079374 0.223811
C 2.364518 -0.422788 -0.891454
C 4.729317 -0.750979 -0.999482
C 3.454343 -1.003790 -1.756663
C 2.137400 0.707843 1.273187
C 0.987661 -0.384405 -1.112830
C 5.450972 0.270961 1.115515
C 6.048389 -1.077327 -1.347966
C 0.134303 0.209253 -0.127975
C 0.740526 0.733093 1.056393
C 6.788030 -0.058702 0.766487
C 7.087041 -0.724183 -0.447884
C -1.875335 0.340349 -1.394387
C -4.367140 0.093249 -0.519075
C -3.360777 0.236362 -1.615032
C -4.042583 0.087691 0.866363
C -5.731492 -0.032734 -0.909009
C -5.057525 -0.042483 1.837542
C -6.751159 -0.165035 0.050295
C -6.398515 -0.168938 1.419261
H 2.553571 1.133945 2.190294
H 0.560747 -0.837755 -2.014290
H 5.240779 0.786566 2.058754
H 6.259496 -1.591922 -2.290978
H 7.603169 0.206481 1.448665
H 8.127088 -0.966498 -0.689875
H -1.339287 0.537972 -2.345333
H -2.998696 0.181939 1.174796
H -5.969969 -0.023387 -1.977583
H -4.805039 -0.046483 2.901480
H -7.796288 -0.263332 -0.255585


