%chk=000246097.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246097

0 1
Br 2.714831 -1.183945 -1.867550
O 1.629309 0.644133 0.443627
O 1.142300 1.694913 -1.499843
O -0.316697 -2.193665 1.909144
C -0.653631 0.773754 -0.150584
C -1.032900 -0.362290 0.583796
C -1.626582 1.692312 -0.575500
C 0.749518 1.089366 -0.533287
C -2.385023 -0.557433 0.898402
C 3.053815 0.796412 0.184430
C -2.972539 1.484345 -0.260741
C -3.351994 0.360971 0.479209
C 3.603637 -0.552506 -0.239386
C -0.043179 -1.395678 1.040036
H -1.326751 2.566893 -1.160107
H 3.445551 1.117523 1.169358
H 3.216595 1.588691 -0.575687
H -2.669854 -1.438266 1.483861
H -3.724318 2.200359 -0.594636
H -4.400894 0.199504 0.730678
H 4.687206 -0.499393 -0.452026
H 3.441912 -1.325882 0.534757
H 0.936787 -1.389319 0.533448


%chk=000246097-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246097

0 1
Br 3.761747 -2.200049 -0.578864
O 1.652256 0.323570 -0.024493
O 0.949548 2.117674 -1.319427
O -0.704007 -2.721109 1.129228
C -0.726851 0.799938 -0.133521
C -1.155363 -0.450399 0.420047
C -1.668673 1.853822 -0.282796
C 0.662873 1.149627 -0.572906
C -2.509286 -0.585206 0.832515
C 3.046021 0.656944 -0.421090
C -3.006057 1.697855 0.129653
C -3.427517 0.472997 0.700338
C 3.966928 -0.355963 0.231253
C -0.298585 -1.680947 0.540421
H -1.323237 2.793921 -0.724180
H 3.280178 1.675453 -0.052635
H 3.124857 0.660639 -1.521869
H -2.810450 -1.553020 1.248351
H -3.713527 2.525052 0.009710
H -4.464707 0.345399 1.028094
H 5.021259 -0.085167 0.068733
H 3.755833 -0.480514 1.303368
H 0.703859 -1.649716 0.071466


