%chk=000187905.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187905

0 1
Br 5.500220 1.081724 -0.002495
Br -5.500194 1.081766 -0.002499
S 0.000016 1.736986 0.003274
O 0.000004 -1.433080 0.002188
C 1.359386 0.640886 0.001245
C -1.359362 0.640896 0.001254
C 1.209687 -0.748681 0.001077
C -1.209673 -0.748673 0.001095
C 2.643113 1.194109 0.000083
C -2.643084 1.194128 0.000098
C 2.318034 -1.612133 -0.000106
C -2.318025 -1.612115 -0.000061
C 3.746467 0.335972 -0.001025
C -3.746444 0.335999 -0.001005
C 3.597118 -1.056876 -0.001090
C -3.597105 -1.056849 -0.001048
H 2.780784 2.279733 0.000096
H -2.780747 2.279753 0.000073
H 2.164131 -2.691109 -0.000178
H -2.164133 -2.691093 -0.000138
H 4.472295 -1.711438 -0.001943
H -4.472287 -1.711406 -0.001896


%chk=000187905-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187905

0 1
Br 5.616908 1.116260 -0.003345
Br -5.616880 1.116301 -0.003314
S 0.000017 1.818659 0.004444
O 0.000004 -1.447094 0.003000
C 1.401306 0.637721 0.001628
C -1.401282 0.637731 0.001636
C 1.240882 -0.767462 0.001508
C -1.240868 -0.767453 0.001515
C 2.702574 1.188150 0.000078
C -2.702546 1.188170 0.000094
C 2.369636 -1.610831 -0.000002
C -2.369628 -1.610813 0.000012
C 3.820922 0.331489 -0.001342
C -3.820899 0.331517 -0.001320
C 3.672399 -1.070085 -0.001360
C -3.672388 -1.070057 -0.001338
H 2.837082 2.273936 0.000048
H -2.837045 2.273957 0.000064
H 2.208815 -2.692516 -0.000066
H -2.208815 -2.692500 -0.000051
H 4.544609 -1.728308 -0.002459
H -4.544602 -1.728274 -0.002431


