%chk=000180109.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180109

0 1
Br 1.844910 -3.634417 -0.000163
Br -1.844871 3.634389 0.000310
Br 5.439580 0.762656 0.000040
Br -5.439554 -0.762680 0.000571
Cl 2.750422 2.719263 -0.000020
Cl -2.750382 -2.719281 0.000144
O -0.230796 -1.447078 -0.000365
O 0.230832 1.447064 -0.000306
C -1.265872 -0.506977 -0.000252
C 1.265906 0.506961 -0.000092
C 1.045569 -0.885861 -0.000144
C -1.045533 0.885845 -0.000170
C 2.564593 1.030335 0.000002
C -2.564560 -1.030352 -0.000069
C 2.131270 -1.765975 0.000002
C -2.131232 1.765954 0.000045
C 3.648202 0.133331 0.000059
C -3.648170 -0.133347 0.000181
C 3.434387 -1.247427 0.000040
C -3.434347 1.247410 0.000259
H 4.287452 -1.937525 0.000047
H -4.287406 1.937512 0.000481


%chk=000180109-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180109

0 1
Br 1.864820 -3.685521 -0.000140
Br -1.864783 3.685503 0.000167
Br 5.536514 0.778726 0.000060
Br -5.536478 -0.778744 0.000404
Cl 2.830097 2.806330 -0.000012
Cl -2.830061 -2.806348 0.000029
O -0.230424 -1.431852 -0.000220
O 0.230461 1.431834 -0.000171
C -1.300878 -0.507860 -0.000048
C 1.300914 0.507842 -0.000106
C 1.074917 -0.888688 -0.000127
C -1.074881 0.888670 -0.000025
C 2.612261 1.024572 -0.000038
C -2.612225 -1.024590 0.000067
C 2.171039 -1.770603 -0.000098
C -2.171003 1.770585 0.000123
C 3.706110 0.125920 -0.000016
C -3.706073 -0.125938 0.000216
C 3.489127 -1.267380 -0.000047
C -3.489090 1.267362 0.000245
H 4.336897 -1.955261 -0.000033
H -4.336861 1.955243 0.000371


