%chk=000268298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268298

0 1
Br -3.646028 1.215716 1.329794
O -2.156133 -2.213302 -0.272317
N 0.040364 -1.750189 -0.050505
C 0.863311 0.540337 -0.099625
C -0.506877 1.013966 -0.239108
C 1.114059 -0.852371 0.006479
C -1.543674 0.118542 -0.285107
C -1.320148 -1.330699 -0.204412
C 1.977693 1.415356 -0.051039
C -0.768310 2.479572 -0.312246
C 2.438515 -1.346064 0.162367
C -2.969099 0.510215 -0.396481
C 3.264882 0.934842 0.097701
C 3.493452 -0.455652 0.206627
H 0.216632 -2.756144 0.027542
H 1.801691 2.492477 -0.134204
H -1.447024 2.738280 -1.139466
H 0.139427 3.086314 -0.441667
H -1.259881 2.830035 0.614897
H 2.612413 -2.416787 0.246125
H -3.622795 -0.356260 -0.640130
H -3.144411 1.304627 -1.142112
H 4.110164 1.619161 0.133708
H 4.515076 -0.820573 0.326179


%chk=000268298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268298

0 1
Br -3.863892 1.093699 1.271258
O -2.216460 -2.241693 -0.299501
N 0.033915 -1.728217 -0.052190
C 0.868286 0.555944 -0.081364
C -0.506758 1.028599 -0.243032
C 1.116536 -0.853387 0.019152
C -1.553548 0.109108 -0.316172
C -1.311489 -1.351493 -0.224819
C 1.989782 1.434308 -0.010921
C -0.751967 2.522601 -0.302148
C 2.436052 -1.351698 0.186580
C -2.986728 0.477517 -0.502238
C 3.294880 0.943016 0.151002
C 3.516697 -0.457455 0.251070
H 0.192857 -2.738362 0.016576
H 1.829873 2.514157 -0.084073
H -1.820500 2.771120 -0.363258
H -0.237271 2.974344 -1.171438
H -0.356906 3.016853 0.604923
H 2.603185 -2.432568 0.263763
H -3.583875 -0.402798 -0.775648
H -3.163890 1.325632 -1.176095
H 4.140904 1.635520 0.202125
H 4.533616 -0.843346 0.379447


