%chk=000231626.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231626

0 1
Br 0.519460 1.874302 -2.636882
C 0.019231 0.619004 -1.164529
C -1.395336 0.832471 -0.695073
C 1.058133 0.739922 -0.087004
C -2.122690 -0.309697 -0.194870
C 2.258484 -0.055948 -0.169585
C -3.466201 -0.134503 0.229897
C 3.222686 0.049067 0.867450
C -1.999205 2.069063 -0.719975
C 0.880676 1.601444 0.974337
C -1.543802 -1.616194 -0.097474
C 2.524282 -0.946998 -1.258524
C -4.066205 1.163665 0.170945
C 2.997051 0.946720 1.959102
C -3.345532 2.235516 -0.286507
C 1.855877 1.705090 2.005093
C -4.205670 -1.258911 0.718985
C 4.414614 -0.742233 0.806212
C -2.271781 -2.677517 0.378992
C 3.676101 -1.691873 -1.296775
C -3.624084 -2.499138 0.790105
C 4.634998 -1.592051 -0.247748
H 0.090056 -0.378408 -1.678509
H -1.470553 2.955763 -1.076927
H -0.014853 2.221058 1.048087
H -0.505195 -1.759495 -0.399045
H 1.799349 -1.016414 -2.071708
H -5.098798 1.279043 0.497460
H 3.748338 1.015483 2.744671
H -3.787000 3.230590 -0.332730
H 1.673997 2.396595 2.827078
H -5.237301 -1.106500 1.033636
H 5.141241 -0.652056 1.612686
H -1.827876 -3.669447 0.453075
H 3.877458 -2.365448 -2.128687
H -4.179108 -3.359513 1.160561
H 5.539061 -2.196252 -0.302522


%chk=000231626-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231626

0 1
Br 0.564509 1.792090 -2.768094
C 0.014222 0.541744 -1.162160
C -1.421392 0.799957 -0.729564
C 1.069458 0.652838 -0.087516
C -2.176011 -0.309219 -0.175016
C 2.324697 -0.066593 -0.208029
C -3.547158 -0.083265 0.245772
C 3.287706 0.023395 0.873839
C -2.022576 2.060326 -0.816803
C 0.831681 1.435406 1.053355
C -1.629074 -1.627740 -0.006502
C 2.669175 -0.863713 -1.350835
C -4.120633 1.224773 0.125400
C 2.994803 0.834170 2.019319
C -3.368221 2.278237 -0.391029
C 1.790340 1.532596 2.103859
C -4.310200 -1.173181 0.782145
C 4.525295 -0.695730 0.781774
C -2.397011 -2.669188 0.520605
C 3.884019 -1.552260 -1.413841
C -3.752505 -2.445178 0.915387
C 4.821014 -1.474845 -0.337343
H 0.079046 -0.424488 -1.683059
H -1.456441 2.889697 -1.251897
H -0.117826 1.971461 1.145589
H -0.586737 -1.827922 -0.274730
H 1.991328 -0.914170 -2.208494
H -5.158025 1.381403 0.444100
H 3.733415 0.895207 2.827492
H -3.804096 3.278510 -0.484757
H 1.568566 2.151679 2.979451
H -5.345894 -0.985724 1.090209
H 5.240043 -0.619018 1.609870
H -1.956581 -3.665305 0.638418
H 4.125960 -2.149439 -2.299809
H -4.344057 -3.270551 1.325984
H 5.769065 -2.019760 -0.399791


