%chk=000287995.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287995

0 1
Br 6.047496 0.736531 -0.210157
Cl -5.671338 -0.217207 -1.239658
S -0.177484 -0.735434 0.346030
O -0.461736 -1.828804 -0.562096
O -0.531392 -0.856208 1.748577
N -0.951300 0.708781 -0.220965
C -2.203705 1.085911 0.484370
C 1.503775 -0.328578 0.197550
C -1.039130 0.807064 -1.700024
C -3.412346 0.249102 0.107864
C 2.072989 0.619994 1.050830
C 2.284122 -0.970218 -0.769376
C -3.556088 -1.076723 0.765483
C 3.430045 0.942848 0.934288
C 3.641054 -0.657704 -0.896133
C 4.194563 0.298923 -0.040871
C -4.292753 0.714238 -0.788191
H -2.021875 1.010982 1.588131
H -2.391789 2.167844 0.286320
H -0.023027 0.794164 -2.129484
H -1.498929 1.766421 -1.992329
H -1.629695 -0.004693 -2.164350
H 1.466130 1.112967 1.817898
H 1.835617 -1.726715 -1.427259
H -3.365068 -1.896398 0.050735
H -2.862207 -1.224142 1.610928
H -4.573287 -1.235176 1.154913
H 3.875848 1.683762 1.600035
H 4.251446 -1.159046 -1.649181
H -4.237438 1.670716 -1.295977


%chk=000287995-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287995

0 1
Br 6.204878 0.835422 -0.374568
Cl -6.103227 0.297264 -1.077161
S -0.132279 -0.774560 0.533061
O -0.370053 -2.157137 -0.312636
O -0.469643 -0.688408 2.126668
N -1.010091 0.741865 -0.247898
C -2.275328 1.067548 0.486444
C 1.667552 -0.286592 0.259655
C -1.122839 0.561907 -1.717002
C -3.538835 0.302478 0.081393
C 2.217996 0.724171 1.063783
C 2.394533 -0.993460 -0.710224
C -3.614717 -1.164469 0.435786
C 3.577321 1.058351 0.872128
C 3.754524 -0.655423 -0.900106
C 4.322727 0.367509 -0.110308
C -4.511223 1.008419 -0.545255
H -2.061672 0.897506 1.560038
H -2.412179 2.156886 0.342548
H -0.120586 0.383134 -2.142589
H -1.504761 1.514065 -2.128035
H -1.804779 -0.252299 -2.030027
H 1.615606 1.228548 1.824952
H 1.918258 -1.796810 -1.281731
H -2.865046 -1.757891 -0.124194
H -3.384812 -1.310675 1.507776
H -4.611534 -1.581794 0.222491
H 4.043979 1.839290 1.478292
H 4.355673 -1.183701 -1.644796
H -4.456943 2.072058 -0.790582


