%chk=000246382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246382

0 1
Br 5.104594 0.737925 0.036933
S -1.636735 -0.356646 -0.039898
O -0.092669 0.341488 -0.014363
O -1.805357 -1.011786 1.229355
O -1.709565 -1.127876 -1.252034
C 1.029722 -0.561471 0.032372
C -2.537537 1.137278 -0.150409
C 2.253296 0.360650 0.014445
C -4.012310 0.873254 0.099393
C 3.535652 -0.450251 0.059958
H 0.989090 -1.223511 -0.853923
H 0.964706 -1.155774 0.963852
H -2.155520 1.894986 0.571064
H -2.397713 1.625131 -1.141254
H 2.192150 1.068772 0.869139
H 2.214428 1.005151 -0.890379
H -4.587316 1.810784 0.083020
H -4.456276 0.219878 -0.666050
H -4.192476 0.410990 1.082983
H 3.637952 -1.121015 -0.811388
H 3.615285 -1.056358 0.979683


%chk=000246382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246382

0 1
Br 5.248009 0.742634 -0.214155
S -1.708634 -0.458557 0.159213
O -0.038039 0.384885 0.373606
O -2.186870 -1.141959 1.545873
O -1.653390 -1.353705 -1.193688
C 1.104722 -0.532455 0.169433
C -2.652379 1.205176 -0.127810
C 2.342170 0.386099 0.094305
C -4.154923 0.953351 -0.069688
C 3.608401 -0.452145 -0.120219
H 0.967185 -1.100850 -0.772060
H 1.179492 -1.237123 1.020508
H -2.264416 1.842557 0.681568
H -2.269603 1.531374 -1.106518
H 2.423487 0.966386 1.029669
H 2.213768 1.102378 -0.735789
H -4.678350 1.917408 -0.208256
H -4.487970 0.267542 -0.867105
H -4.456274 0.538395 0.906985
H 3.604242 -0.997676 -1.076674
H 3.812773 -1.142115 0.713299


