%chk=000293006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293006

0 1
Br 4.879915 1.708494 -1.729294
O -0.717492 -1.339235 2.372291
O -1.749158 2.811552 -0.434052
O -0.666262 1.865498 1.274643
C 0.805325 -0.732829 0.648903
C -1.719233 -0.770219 0.299894
C -0.545826 -0.970034 1.234019
C -2.129930 0.503322 -0.127806
C 3.376806 -0.295847 -0.372493
C 1.059006 -0.924071 -0.717676
C 1.838768 -0.315178 1.501001
C 2.339388 -0.711533 -1.226031
C 3.119593 -0.091953 0.991642
C -2.413848 -1.906162 -0.130817
C -3.228123 0.628563 -0.994028
C -3.507480 -1.775423 -0.992740
C -3.912553 -0.509381 -1.426757
C 4.748491 -0.079386 -0.918007
C -1.428016 1.719933 0.347074
H 0.257114 -1.241368 -1.386150
H 1.628999 -0.159674 2.563843
H 2.533066 -0.852870 -2.288741
H 3.912858 0.249227 1.655977
H -2.108453 -2.894387 0.218183
H -3.539969 1.623727 -1.326697
H -4.047119 -2.664314 -1.322679
H -4.764621 -0.408166 -2.099084
H 5.010029 -0.805905 -1.710069
H 5.534041 -0.132033 -0.141158
H -1.284915 3.638652 -0.127491


%chk=000293006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293006

0 1
Br 5.332478 1.887981 -1.119908
O -0.695683 -1.306725 2.393247
O -1.859568 2.844199 -0.723301
O -0.620316 1.895912 0.993337
C 0.829120 -0.651778 0.639804
C -1.755133 -0.731248 0.313152
C -0.538044 -0.881660 1.210933
C -2.172561 0.499379 -0.276407
C 3.467618 -0.289683 -0.364166
C 1.059090 -0.568131 -0.758691
C 1.930644 -0.560818 1.531747
C 2.365854 -0.393558 -1.253534
C 3.231693 -0.375881 1.035937
C -2.519094 -1.898411 0.070383
C -3.313169 0.532012 -1.120332
C -3.652726 -1.860597 -0.770895
C -4.045784 -0.644270 -1.376400
C 4.856037 -0.113420 -0.891950
C -1.466062 1.761165 0.076776
H 0.220819 -0.655750 -1.458339
H 1.735513 -0.632807 2.606297
H 2.537889 -0.329287 -2.334448
H 4.075462 -0.287264 1.730412
H -2.215977 -2.835568 0.548058
H -3.618551 1.488856 -1.552081
H -4.227229 -2.775759 -0.950030
H -4.924947 -0.610874 -2.028164
H 4.997982 -0.517232 -1.904423
H 5.636139 -0.476861 -0.208371
H -1.371093 3.657077 -0.422942


