%chk=000197994.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197994

0 1
Br 1.050614 2.158682 0.662574
O -1.694265 -0.772002 -0.345332
O 2.999236 -0.991823 0.681448
O -1.804128 1.178162 0.803165
C 0.448219 -1.821308 -0.420237
C 1.332902 -0.725032 -1.020709
C -0.622764 -1.275512 0.517993
C 2.372776 -0.244974 -0.032159
C 2.634133 1.250283 0.001634
C -2.196879 0.485939 -0.106646
C -3.248415 0.780882 -1.119347
H 1.078989 -2.554981 0.129944
H -0.042541 -2.387300 -1.240431
H 0.695571 0.102374 -1.396752
H 1.862737 -1.119366 -1.914684
H -1.107299 -2.068914 1.113376
H -0.263195 -0.469477 1.185738
H 3.478714 1.486823 0.679684
H 2.884090 1.653780 -0.994384
H -3.397290 -0.049675 -1.827438
H -2.988393 1.679473 -1.700398
H -4.214310 0.981565 -0.628740


%chk=000197994-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197994

0 1
Br 1.737907 2.795843 -0.473600
O -1.477572 -0.452328 -0.476055
O 2.382290 -0.444485 1.284700
O -3.078064 -0.240405 1.204374
C 0.513611 -1.840701 -0.387534
C 1.422219 -0.731183 -0.952795
C -0.654170 -1.301226 0.440543
C 2.263625 -0.021925 0.104230
C 3.027267 1.230619 -0.330799
C -2.679452 0.036624 0.051096
C -3.374685 0.938787 -0.945877
H 1.106164 -2.509982 0.263657
H 0.115352 -2.446052 -1.222178
H 0.822648 0.017298 -1.504603
H 2.130923 -1.158286 -1.694674
H -1.289656 -2.112843 0.836188
H -0.316575 -0.678994 1.287519
H 3.766039 1.523123 0.428054
H 3.471679 1.137783 -1.334183
H -3.123571 0.657636 -1.980027
H -3.044422 1.981374 -0.783091
H -4.463056 0.896921 -0.786646


