%chk=000186274.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186274

0 1
Br -0.290905 1.694758 2.100430
O -0.189236 1.049945 -1.979930
O -3.127642 2.095136 1.047918
O -3.005779 0.116509 -1.702734
C 0.012787 0.786891 -0.595237
C -0.437674 -0.600481 -0.157442
C -0.822826 1.810900 0.204566
C -2.338289 1.565012 0.000136
C 1.520530 0.709114 -0.373869
C -2.787393 0.087332 -0.269021
C -1.755746 -0.965408 0.036196
C 0.658230 -1.427351 0.189720
C 1.882873 -0.616699 0.039910
C -2.009586 -2.266573 0.506846
C 0.403456 -2.712667 0.648926
C 2.480975 1.680497 -0.563719
C 3.209378 -0.941532 0.262134
C -0.939559 -3.120928 0.787622
C 3.831456 1.341011 -0.330915
C 4.186775 0.057357 0.071604
H -0.570998 2.850071 -0.108477
H -2.680763 2.179941 -0.882721
H -3.764741 -0.100015 0.229830
H -3.031924 -2.603283 0.664288
H 1.213344 -3.388816 0.912433
H -1.086210 0.714231 -2.272532
H 2.211838 2.683156 -0.891335
H 3.499757 -1.940997 0.576084
H -1.144933 -4.131064 1.144539
H -2.890558 1.716584 1.927586
H -3.228555 -0.779076 -2.034648
H 4.599942 2.099821 -0.473614
H 5.234375 -0.187678 0.243928


%chk=000186274-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186274

0 1
Br -0.352539 1.635530 2.255011
O -0.275316 1.116994 -1.988493
O -3.210993 2.019179 1.138052
O -2.847141 0.149692 -1.879954
C -0.001909 0.775526 -0.572866
C -0.437017 -0.616063 -0.155014
C -0.842637 1.788827 0.249486
C -2.383980 1.547354 0.039359
C 1.511323 0.696130 -0.374350
C -2.780113 0.080341 -0.369863
C -1.775431 -0.979401 0.023916
C 0.654276 -1.431463 0.212758
C 1.884542 -0.617791 0.052179
C -2.046438 -2.275634 0.529728
C 0.387785 -2.728874 0.705117
C 2.480352 1.678533 -0.612037
C 3.240236 -0.938931 0.261385
C -0.965066 -3.138413 0.847806
C 3.845533 1.354189 -0.399867
C 4.219350 0.059456 0.034369
H -0.572294 2.830994 0.022016
H -2.681427 2.176003 -0.819570
H -3.793826 -0.112094 0.023285
H -3.078713 -2.606680 0.694681
H 1.196630 -3.404189 1.004498
H -1.200525 0.773640 -2.211485
H 2.192897 2.674807 -0.963657
H 3.539372 -1.939831 0.591683
H -1.179994 -4.138894 1.239594
H -2.735199 1.842837 1.995826
H -3.045868 -0.754525 -2.233608
H 4.618146 2.110903 -0.574892
H 5.278381 -0.172455 0.193409


