%chk=000232052.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232052

0 1
Br -1.425244 -2.848875 0.073201
Br 1.881965 2.868062 0.305842
O -1.071805 2.438319 0.358316
O 1.528184 -2.418060 0.018865
C -2.670413 0.031016 0.302999
C -3.459557 -0.043714 -0.861710
C -1.193646 0.002232 0.239264
C -4.868753 -0.028457 -0.749087
C 1.649997 0.016274 0.167978
C 3.125630 -0.016689 0.143078
C -5.467593 0.092193 0.521792
C -0.463642 1.213459 0.284098
C -3.275773 0.128896 1.564465
C -0.486558 -1.200299 0.149118
C 0.919638 -1.194096 0.113839
C 0.942533 1.219371 0.248158
C 3.835386 0.120333 -1.069302
C -4.662302 0.167762 1.670120
C -2.802260 -0.154010 -2.199823
C -5.710889 -0.136404 -1.982288
C 3.825071 -0.177643 1.348579
C 5.235907 0.070759 -1.050716
C -6.953990 0.143980 0.683744
C 5.932163 -0.100869 0.154209
C 5.217853 -0.224527 1.357659
C 3.104195 0.322530 -2.354194
C 7.425537 -0.134239 0.159169
H -2.656326 0.164991 2.460876
H -5.125066 0.248957 2.652149
H -2.796281 -1.203506 -2.536040
H -3.311269 0.441707 -2.968251
H -1.754009 0.175797 -2.189729
H -5.315542 -0.888592 -2.679883
H -6.745820 -0.432758 -1.770582
H -5.749927 0.824207 -2.515143
H 3.270869 -0.259019 2.284972
H 5.789022 0.176761 -1.981737
H -7.389819 0.977174 0.114170
H -7.425784 -0.784059 0.328814
H -7.260633 0.276483 1.729655
H 5.749594 -0.347621 2.298263
H 3.763943 0.314244 -3.230329
H 2.337734 -0.449613 -2.514508
H 2.581029 1.294180 -2.350585
H 7.836714 -0.582105 -0.755515
H 7.833926 0.885705 0.231408
H 7.830783 -0.703986 1.006001
H -2.067446 2.350198 0.383388
H 2.523776 -2.330347 0.016632


%chk=000232052-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232052

0 1
Br -1.340500 -2.945685 0.048810
Br 1.818544 2.957856 0.421745
O -1.185309 2.423851 0.430208
O 1.660004 -2.403856 -0.008243
C -2.700424 0.019876 0.289838
C -3.515348 -0.117990 -0.873569
C -1.200674 -0.028001 0.229986
C -4.938594 -0.058107 -0.750809
C 1.670438 0.047713 0.174602
C 3.170587 0.001968 0.144110
C -5.543325 0.156783 0.524211
C -0.497730 1.211639 0.320549
C -3.311075 0.242165 1.551516
C -0.444076 -1.217613 0.128444
C 0.968943 -1.192640 0.101092
C 0.915245 1.236301 0.286487
C 3.894559 0.207529 -1.070614
C -4.712839 0.308620 1.662326
C -2.886515 -0.337357 -2.237962
C -5.790340 -0.222914 -1.999711
C 3.880463 -0.285329 1.338525
C 5.308058 0.130499 -1.035009
C -7.052802 0.228452 0.696153
C 6.027117 -0.138943 0.157571
C 5.289850 -0.354334 1.348367
C 3.171450 0.509824 -2.370031
C 7.545151 -0.173192 0.159752
H -2.681708 0.338290 2.443486
H -5.171582 0.473234 2.644116
H -3.076275 -1.366337 -2.600633
H -3.303293 0.353852 -2.993707
H -1.794884 -0.195443 -2.207630
H -5.509247 -1.134510 -2.559335
H -6.863650 -0.291014 -1.766662
H -5.654312 0.628424 -2.695549
H 3.318040 -0.440942 2.266331
H 5.865964 0.288367 -1.967047
H -7.501477 1.031279 0.081491
H -7.544663 -0.718380 0.402685
H -7.316285 0.426734 1.748739
H 5.817717 -0.572092 2.284215
H 3.871695 0.525501 -3.222271
H 2.385435 -0.238079 -2.582749
H 2.670419 1.494979 -2.321130
H 7.945438 -0.541185 -0.801381
H 7.961402 0.840210 0.321523
H 7.935632 -0.820110 0.964617
H -2.162229 2.237462 0.480383
H 2.638109 -2.221256 0.023564


