%chk=000240804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240804

0 1
Br -2.545876 2.667157 0.748888
Cl 4.617081 1.903112 -0.102009
N -0.407126 0.966543 -0.341201
N 1.068520 -0.847173 0.171493
N 3.496660 -0.432107 0.316077
N 2.590600 -2.595971 0.629864
C -1.609767 0.198704 -0.282815
C 0.882863 0.478371 -0.139171
C -2.763321 0.867669 0.178586
C -1.712366 -1.140547 -0.692443
C 1.979830 1.383270 -0.244558
C -3.999620 0.231157 0.226466
C -2.953111 -1.779662 -0.635466
C -4.091821 -1.103386 -0.184427
C 2.375116 -1.256980 0.379395
C 3.248276 0.859933 -0.003228
H -0.492905 1.972288 -0.535565
H -0.828502 -1.680603 -1.041363
H 1.839709 2.428362 -0.492806
H -4.883570 0.761446 0.584116
H -3.031962 -2.821027 -0.951083
H -5.052462 -1.614609 -0.149032
H 3.509770 -2.902657 0.915408
H 1.806183 -3.195290 0.837071


%chk=000240804-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240804

0 1
Br -2.754104 2.928723 -0.193578
Cl 4.661660 2.035284 0.176917
N -0.396775 0.875324 -0.053713
N 1.173968 -0.930441 0.040808
N 3.573051 -0.442346 0.149630
N 2.775102 -2.638433 0.138069
C -1.629815 0.190934 -0.103517
C 0.912020 0.409972 0.014660
C -2.837043 0.951391 -0.170707
C -1.755118 -1.228070 -0.089705
C 1.965023 1.383823 0.055161
C -4.104355 0.348090 -0.221706
C -3.024304 -1.836803 -0.140709
C -4.203585 -1.062241 -0.206918
C 2.493768 -1.296337 0.106717
C 3.262925 0.863106 0.121865
H -0.486655 1.896567 -0.072505
H -0.835630 -1.812270 -0.039368
H 1.770524 2.457420 0.036078
H -5.002619 0.969956 -0.272483
H -3.089073 -2.930236 -0.128325
H -5.188663 -1.537207 -0.246991
H 3.746150 -2.935560 0.185809
H 2.015748 -3.312646 0.106709


