%chk=000179818.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179818

0 1
Br 0.168751 2.421205 0.332964
Br 2.009439 -2.472144 -1.467713
Br 4.156571 2.072255 0.879897
O -0.619936 -0.574591 -2.148826
N -1.343320 0.058656 -0.012946
N 0.995653 -0.016903 -0.582240
N 3.246287 -0.226362 -0.287937
C -1.127919 -0.412301 1.390941
C -2.771781 0.001316 -0.473148
C -0.396306 -0.266779 -1.004901
C 1.461659 1.171401 0.023047
C -1.192541 -1.914762 1.497183
C -3.539172 1.127213 0.164040
C 2.138832 -0.820828 -0.749734
C 2.832722 1.020340 0.187577
C -0.111214 -2.675259 1.646439
C -4.819327 1.020556 0.510332
H -0.155049 -0.025752 1.774676
H -1.911460 0.061097 2.030133
H -2.808048 0.119958 -1.587807
H -3.224537 -0.991690 -0.255292
H -2.195378 -2.339919 1.445474
H -2.973270 2.052051 0.298965
H -0.153372 -3.754120 1.729527
H 0.900815 -2.291209 1.697203
H -5.383845 1.838298 0.938399
H -5.409955 0.123173 0.391750


%chk=000179818-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179818

0 1
Br 0.719405 2.779893 0.560792
Br 1.480153 -2.523517 -1.739347
Br 4.309440 1.622840 1.141681
O -0.656832 0.350398 -2.359646
N -1.455953 -0.106974 -0.201312
N 0.897768 0.086524 -0.587246
N 3.052598 -0.574552 -0.285300
C -1.208153 -0.484194 1.221676
C -2.876286 -0.076563 -0.658609
C -0.475683 0.121070 -1.138234
C 1.565647 1.127349 0.106327
C -0.962036 -1.970180 1.406420
C -3.645989 1.072481 -0.037324
C 1.864410 -0.899454 -0.806046
C 2.878163 0.687450 0.277113
C 0.103278 -2.481099 2.069684
C -4.772930 0.921520 0.701383
H -0.366571 0.096937 1.631237
H -2.113569 -0.170360 1.775438
H -2.851253 0.020961 -1.758328
H -3.353857 -1.042314 -0.407135
H -1.716424 -2.645749 0.977459
H -3.243138 2.075714 -0.236637
H 0.233262 -3.560764 2.199071
H 0.880477 -1.837019 2.500537
H -5.314253 1.783805 1.104896
H -5.197375 -0.069303 0.909454


