%chk=000223913.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223913

0 1
Br 8.926312 -0.411132 0.066070
O -6.336152 -0.596373 0.370366
O -5.555955 1.212942 -0.739646
C 0.981651 -0.485635 -0.100563
C 2.210010 0.425456 0.027285
C -0.321992 0.321121 -0.033670
C 3.513793 -0.381277 -0.038708
C -1.550634 -0.589414 -0.163267
C 4.741791 0.530058 0.088029
C -2.849643 0.222194 -0.096670
C 6.043915 -0.282939 0.022541
C -4.078339 -0.685920 -0.220751
C 7.252581 0.630593 0.148604
C -5.341704 0.125740 -0.260807
C -7.660599 -0.003382 0.404730
H 0.994079 -1.249032 0.701336
H 1.028091 -1.048278 -1.053120
H 2.197422 1.188289 -0.775275
H 2.162903 0.989002 0.979246
H -0.333462 1.085513 -0.835173
H -0.368108 0.883940 0.918923
H 3.559345 -0.945594 -0.990563
H 3.525408 -1.144065 0.764113
H -1.502597 -1.150703 -1.116789
H -1.538833 -1.353439 0.638296
H 4.729118 1.290966 -0.716506
H 4.694335 1.093726 1.040075
H -2.896730 0.790944 0.853417
H -2.868698 0.986495 -0.902311
H 6.052389 -1.048935 0.825447
H 6.086897 -0.852370 -0.928989
H -4.115458 -1.420334 0.613326
H -4.022903 -1.297190 -1.148520
H 7.269617 1.170472 1.110516
H 7.305279 1.368834 -0.669501
H -8.183469 -0.618426 1.144166
H -8.109808 -0.088062 -0.589104
H -7.599253 1.045617 0.713950


%chk=000223913-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223913

0 1
Br 9.110462 -0.443225 -0.027842
O -6.532466 -0.716024 -0.166691
O -5.575159 1.330952 0.396068
C 1.000520 -0.471750 0.002382
C 2.257876 0.426712 -0.002298
C -0.320238 0.330297 0.007955
C 3.579095 -0.374617 -0.007702
C -1.579245 -0.565520 0.012906
C 4.834523 0.528359 -0.011151
C -2.892707 0.246587 0.024515
C 6.150778 -0.293006 -0.016930
C -4.139650 -0.659153 0.017886
C 7.373060 0.625566 -0.019813
C -5.441578 0.119903 0.108495
C -7.867942 -0.077238 -0.075350
H 1.029014 -1.137639 0.890229
H 1.021952 -1.137225 -0.885986
H 2.228612 1.092574 -0.890044
H 2.235462 1.091921 0.886115
H -0.348275 0.996472 -0.879474
H -0.341576 0.995831 0.895959
H 3.602763 -1.038383 -0.896667
H 3.608893 -1.040080 0.879802
H -1.558763 -1.229441 -0.876853
H -1.548902 -1.232864 0.899990
H 4.804923 1.192679 -0.899511
H 4.811275 1.190463 0.879035
H -2.923539 0.903454 0.914368
H -2.922902 0.920759 -0.853632
H 6.181898 -0.952156 0.871242
H 6.175721 -0.949556 -0.907221
H -4.110534 -1.361475 0.875951
H -4.174544 -1.294643 -0.886930
H 7.440112 1.250003 0.884881
H 7.433602 1.253033 -0.922875
H -8.579508 -0.877190 -0.323330
H -7.942286 0.758450 -0.791443
H -8.040126 0.306577 0.944470


