%chk=000236859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236859

0 1
Br -4.980982 0.855192 -0.000191
S -0.997400 -3.278587 -0.000172
O 0.270241 2.725453 0.000018
N 0.644181 -2.734214 -0.000199
N -2.450418 2.439578 0.000116
C -0.627894 -0.753215 -0.000230
C -0.815834 0.636029 -0.000133
C 0.687722 -1.418282 -0.000246
C 1.883059 -0.563494 -0.000255
C 1.713482 0.842129 -0.000231
C -1.681688 -1.675433 -0.000214
C 0.370130 1.504257 -0.000119
C -2.157077 1.107386 -0.000050
C -3.012920 -1.224815 -0.000130
C -3.228057 0.137106 -0.000114
C 3.170440 -1.115954 -0.000292
C 2.847826 1.666120 -0.000269
C 4.290118 -0.278007 -0.000355
C 4.130490 1.110279 -0.000357
H -3.843755 -1.934784 -0.000123
H 3.292687 -2.202044 -0.000242
H 2.713136 2.753334 -0.000239
H 5.290101 -0.713271 -0.000397
H 5.003668 1.761813 -0.000439
H -3.388245 2.807167 0.000145
H -1.682512 3.122055 0.000118


%chk=000236859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236859

0 1
Br -5.094263 0.806622 0.000067
S -1.008331 -3.380609 -0.000254
O 0.247098 2.793287 -0.000101
N 0.697051 -2.765517 -0.000304
N -2.408393 2.478564 -0.000016
C -0.624248 -0.773239 -0.000175
C -0.825392 0.628685 -0.000125
C 0.671867 -1.410657 -0.000253
C 1.875222 -0.571650 -0.000268
C 1.702663 0.853763 -0.000211
C -1.691772 -1.696196 -0.000163
C 0.354803 1.504182 -0.000146
C -2.174868 1.132022 -0.000059
C -3.029550 -1.230832 -0.000093
C -3.241283 0.154632 -0.000039
C 3.181645 -1.124723 -0.000332
C 2.851480 1.687907 -0.000216
C 4.306817 -0.280486 -0.000337
C 4.142202 1.130228 -0.000277
H -3.881475 -1.915599 -0.000080
H 3.290116 -2.213481 -0.000377
H 2.695168 2.771112 -0.000173
H 5.313128 -0.712833 -0.000385
H 5.021293 1.783210 -0.000279
H -3.360129 2.842408 0.000029
H -1.570351 3.085000 -0.000035


