%chk=000298604.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298604

0 1
Br 5.441454 -0.296070 -0.212379
S 2.594631 -0.880413 1.051471
O -0.157233 -1.533061 1.857605
C -1.385482 -0.130050 0.383493
C 1.127594 -0.433586 0.250653
C -0.140493 -0.764905 0.917548
C -1.438509 1.246123 0.123725
C -2.518234 -0.930858 0.180618
C 1.387600 0.155302 -0.959133
C -2.621765 1.816481 -0.352729
C -3.696313 -0.356833 -0.305267
C 2.791717 0.262984 -1.240680
C -3.747942 1.015220 -0.572039
C 3.571801 -0.249798 -0.239247
H -0.564027 1.872123 0.303944
H -2.476420 -1.997523 0.409610
H 0.631519 0.504217 -1.653376
H -2.667842 2.886318 -0.550719
H -4.575722 -0.978331 -0.468797
H 3.167524 0.705598 -2.155109
H -4.668359 1.462161 -0.946892


%chk=000298604-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298604

0 1
Br 5.569676 -0.353058 -0.092309
S 2.643994 -1.033280 1.073087
O -0.212065 -1.767756 1.639789
C -1.402348 -0.163129 0.283291
C 1.155835 -0.435895 0.212583
C -0.149731 -0.839571 0.766955
C -1.447638 1.209196 -0.082427
C -2.600308 -0.927136 0.268442
C 1.498308 0.267925 -0.945718
C -2.669745 1.799591 -0.472339
C -3.815102 -0.339700 -0.136884
C 2.909456 0.375712 -1.179169
C -3.852550 1.025550 -0.511382
C 3.654971 -0.255860 -0.190840
H -0.544400 1.824427 -0.015522
H -2.554698 -1.974391 0.584720
H 0.750236 0.667305 -1.633483
H -2.701352 2.862538 -0.735459
H -4.731850 -0.938804 -0.156732
H 3.353359 0.886663 -2.035166
H -4.798549 1.484771 -0.819139


