%chk=000230186.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230186

0 1
Br -0.137107 4.271146 0.309772
Br 2.609700 1.324923 -2.919581
O -0.606469 1.202646 0.270331
O 2.430039 -2.553269 1.688083
O 3.993214 -2.934573 -0.058690
C 0.610410 1.590861 -0.401712
C -2.805402 0.423412 0.342258
C -3.997823 -0.193243 -0.395536
C -1.615393 0.613225 -0.596913
C 1.557658 0.401699 -0.393363
C 1.133197 2.739192 0.485149
C -5.193753 -0.384335 0.546825
C -6.393248 -1.001620 -0.185901
C 1.465616 -0.482380 0.717787
C 2.476900 0.157586 -1.410440
C 2.319573 -1.557073 0.730082
C 2.520477 3.211756 0.121624
C 3.261471 -1.788357 -0.321874
C 3.361857 -0.948791 -1.405930
C -7.586107 -1.193529 0.747907
C 3.488543 -3.453226 1.218667
H 0.377957 1.934820 -1.435973
H -2.503259 -0.209073 1.200651
H -3.079614 1.402723 0.786702
H -4.291179 0.452158 -1.246640
H -3.708656 -1.166861 -0.836985
H -1.223762 -0.337720 -0.994442
H -1.833120 1.312853 -1.421782
H 1.061465 2.443568 1.558438
H -4.904122 -1.027041 1.400474
H -5.484667 0.587928 0.989886
H -6.686315 -0.357388 -1.038006
H -6.104685 -1.975324 -0.627936
H 0.725021 -0.299669 1.500551
H 3.258704 2.400922 0.213823
H 2.583040 3.587616 -0.910396
H 2.856504 4.029252 0.775779
H 4.074721 -1.124599 -2.210595
H -8.437680 -1.633883 0.217312
H -7.341644 -1.857956 1.584506
H -7.922403 -0.241412 1.174249
H 4.310884 -3.415201 1.945369
H 3.036456 -4.435562 1.027568


%chk=000230186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230186

0 1
Br 0.212957 4.556131 0.444410
Br 2.223100 1.165163 -3.157362
O -0.616342 1.462439 0.409962
O 2.480938 -2.483827 1.768403
O 3.725913 -3.096903 -0.193795
C 0.642382 1.749052 -0.283802
C -2.856880 0.538237 0.422656
C -3.983087 -0.177863 -0.357817
C -1.606547 0.762649 -0.431224
C 1.501962 0.478908 -0.366714
C 1.343328 2.844256 0.551364
C -5.241972 -0.427800 0.502782
C -6.374151 -1.145547 -0.266766
C 1.542078 -0.355673 0.794812
C 2.241480 0.085275 -1.507571
C 2.320937 -1.507453 0.755258
C 2.771420 3.192966 0.124416
C 3.052656 -1.871839 -0.396296
C 3.030443 -1.096811 -1.555453
C -7.626915 -1.396348 0.600109
C 3.485245 -3.443984 1.236958
H 0.447158 2.135142 -1.304549
H -2.577897 -0.058298 1.313391
H -3.214252 1.518246 0.792831
H -4.262470 0.426802 -1.245900
H -3.608580 -1.148385 -0.746101
H -1.188795 -0.205642 -0.783842
H -1.837720 1.389885 -1.319829
H 1.279855 2.579828 1.620626
H -4.964626 -1.031615 1.392099
H -5.620174 0.540738 0.890950
H -6.652518 -0.540126 -1.153700
H -5.993305 -2.111432 -0.657500
H 0.936179 -0.088203 1.664401
H 3.427324 2.309650 0.240534
H 2.809472 3.517927 -0.928836
H 3.170766 4.004991 0.753559
H 3.583665 -1.385602 -2.450717
H -8.420931 -1.908689 0.026174
H -7.383653 -2.026143 1.476763
H -8.044352 -0.443982 0.978124
H 4.430536 -3.326569 1.797036
H 3.072371 -4.463351 1.291254


