%chk=000297478.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297478

0 1
Br 2.329612 -1.417897 -1.102537
O 0.253228 1.970826 -0.678588
N 1.034961 0.267921 0.619601
C -1.313494 0.254899 -0.049443
C 0.026980 0.920643 -0.102225
C 2.404315 0.813406 0.646679
C -2.420440 1.023996 0.336693
C -1.475851 -1.087798 -0.411905
C -3.688862 0.439418 0.378317
C -2.748511 -1.665298 -0.373200
C -3.852627 -0.904464 0.025180
C 3.318822 -0.061903 -0.162553
C 4.635178 0.040916 -0.261377
H 2.763455 0.896782 1.698523
H 2.399060 1.853014 0.213608
H 0.858299 -0.581270 1.148125
H -2.287725 2.077022 0.591851
H -0.619416 -1.678854 -0.736372
H -4.550626 1.033343 0.679643
H -2.879635 -2.708218 -0.657736
H -4.842970 -1.357698 0.055663
H 5.252837 -0.608852 -0.869790
H 5.211808 0.797365 0.258643


%chk=000297478-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297478

0 1
Br 2.958405 -0.358268 -2.292783
O 0.009899 2.298857 -0.193493
N 1.093137 0.317035 0.354895
C -1.353734 0.301718 0.082419
C -0.049153 1.054614 0.061098
C 2.426293 0.923466 0.302344
C -2.540126 1.055895 0.269728
C -1.444808 -1.102538 -0.107056
C -3.795969 0.415333 0.294777
C -2.703721 -1.742212 -0.087969
C -3.880888 -0.986684 0.120771
C 3.446059 0.073134 -0.425521
C 4.622387 -0.363389 0.077738
H 2.817624 1.114769 1.322678
H 2.294695 1.905154 -0.190928
H 1.011149 -0.655917 0.651058
H -2.449639 2.141067 0.383413
H -0.549052 -1.700022 -0.317033
H -4.706694 1.005046 0.445404
H -2.767527 -2.824148 -0.247302
H -4.856531 -1.485035 0.136132
H 5.340377 -0.939214 -0.510832
H 4.886216 -0.131361 1.117262


