%chk=000180874.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180874

0 1
Br 1.616744 -0.055671 1.305752
O 1.812275 -1.975074 -1.234496
O 4.629873 0.237805 -1.514119
O 5.823627 2.417106 0.830973
O 4.496186 0.727566 1.460440
C -3.568282 -1.270779 0.573674
C -3.879792 0.212004 0.917590
C -3.690867 1.169029 -0.265385
C -2.134833 -1.419845 0.059609
C -4.607315 -1.777618 -0.443202
C -3.683108 -2.116360 1.860710
C -3.994112 2.618815 0.136241
C -3.806909 3.579108 -1.046938
C -1.091125 -0.771482 0.744038
C -1.818492 -2.220272 -1.049113
C 0.232326 -0.905299 0.324138
C -0.501041 -2.353542 -1.488051
C 0.526903 -1.692732 -0.799569
C -4.107709 5.024088 -0.654966
C 2.584814 -0.858729 -1.764161
C 3.968521 -1.002100 -1.125432
C 5.725638 0.622062 -0.694972
C 5.237435 1.190982 0.629321
H -4.919730 0.281859 1.290777
H -3.244130 0.538821 1.763696
H -2.654484 1.094084 -0.650417
H -4.345473 0.866854 -1.105557
H -4.504258 -2.851014 -0.633428
H -4.523031 -1.252810 -1.401426
H -5.626905 -1.614982 -0.075631
H -4.693817 -2.075422 2.278513
H -2.990737 -1.775159 2.637505
H -3.451247 -3.169274 1.664395
H -5.028280 2.697195 0.522399
H -3.337170 2.924986 0.973031
H -4.462619 3.275379 -1.886148
H -2.770382 3.504488 -1.430829
H -1.319772 -0.156508 1.618974
H -2.602595 -2.753267 -1.588274
H -0.251374 -2.972858 -2.348257
H -3.447576 5.369569 0.148845
H -5.139290 5.141270 -0.304442
H -3.970806 5.701548 -1.505160
H 2.126580 0.119901 -1.544410
H 2.603577 -1.025098 -2.855959
H 4.549454 -1.838570 -1.546013
H 3.906911 -1.098927 -0.024779
H 6.423962 -0.216943 -0.511601
H 6.224914 1.404118 -1.311636
H 5.549221 2.846300 1.686047


%chk=000180874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180874

0 1
Br 1.132233 -0.148694 2.431360
O 1.958056 -1.485507 -0.350520
O 4.780397 0.657682 -1.305977
O 8.257948 0.840082 -0.086325
O 6.291266 0.931743 1.157913
C -3.813509 -1.364839 0.456988
C -4.302862 0.101073 0.726064
C -4.086213 1.109085 -0.424783
C -2.287374 -1.380723 0.204481
C -4.608178 -1.966342 -0.731115
C -4.123762 -2.222442 1.722387
C -4.495808 2.547735 -0.033855
C -4.314586 3.566455 -1.182363
C -1.412748 -0.851887 1.193655
C -1.699706 -1.921703 -0.966708
C -0.018946 -0.858062 1.009667
C -0.300067 -1.925955 -1.149534
C 0.563533 -1.392018 -0.168171
C -4.719326 5.002145 -0.783460
C 2.621016 -0.247029 -0.832504
C 4.118117 -0.495906 -0.667442
C 6.220980 0.575722 -1.314485
C 6.862651 0.801414 0.058782
H -5.383774 0.054744 0.974283
H -3.796981 0.487640 1.634711
H -3.019828 1.102980 -0.728041
H -4.669728 0.800565 -1.315460
H -4.362707 -3.034021 -0.881656
H -4.418115 -1.432954 -1.679211
H -5.691472 -1.899943 -0.520831
H -5.212226 -2.229457 1.920621
H -3.619540 -1.822588 2.620714
H -3.789485 -3.266832 1.583803
H -5.556307 2.554107 0.296044
H -3.896410 2.874783 0.841677
H -4.915035 3.240447 -2.056371
H -3.255733 3.557298 -1.512251
H -1.818939 -0.435351 2.120519
H -2.330518 -2.347048 -1.751824
H 0.151817 -2.354182 -2.050544
H -4.110803 5.362553 0.067428
H -5.781668 5.043773 -0.476413
H -4.581601 5.710429 -1.621163
H 2.301826 0.624508 -0.232505
H 2.365681 -0.078538 -1.896867
H 4.406457 -1.437547 -1.181294
H 4.384360 -0.558634 0.403259
H 6.588405 -0.398710 -1.705946
H 6.577149 1.367213 -1.995892
H 8.683762 0.987338 0.801455


