%chk=000231645.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231645

0 1
Br 6.533209 0.434133 -0.094533
O -4.960276 -0.004183 1.040038
O -4.671533 0.671602 -1.100645
O 4.168788 -0.741308 1.428950
C -1.881485 -0.184219 -0.870092
C -0.420890 -0.138155 -0.515447
C -2.740205 0.192098 0.342359
C 0.325619 1.028163 -0.749694
C 0.202515 -1.256142 0.059562
C 2.306636 -0.046539 0.143504
C 1.681709 1.072450 -0.424091
C 1.556355 -1.207384 0.392619
C -4.185190 0.329495 -0.049987
C 3.752666 -0.057212 0.526088
C 4.644759 0.840419 -0.311426
C -6.400202 0.107069 0.883342
H -2.163944 -1.193060 -1.239965
H -2.108964 0.500185 -1.718971
H -2.625116 -0.554862 1.159060
H -2.397648 1.155815 0.783120
H -0.154532 1.902470 -1.187857
H -0.369320 -2.163357 0.251080
H 2.243244 1.988449 -0.607213
H 2.043451 -2.071398 0.855119
H 4.412175 0.745596 -1.389287
H 4.503144 1.900495 -0.025107
H -6.674247 1.166204 0.883002
H -6.779890 -0.413977 1.768559
H -6.719127 -0.377047 -0.045885


%chk=000231645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231645

0 1
Br 6.559091 0.969003 0.513943
O -4.967002 0.267507 1.199183
O -4.770875 0.151080 -1.119554
O 4.357527 -1.196603 0.863856
C -1.913889 -0.264709 -0.940020
C -0.424048 -0.236355 -0.644009
C -2.745856 0.116353 0.311437
C 0.349390 0.922633 -0.912491
C 0.225070 -1.357696 -0.059350
C 2.367520 -0.156603 -0.018449
C 1.724712 0.966882 -0.606557
C 1.595883 -1.321254 0.249422
C -4.236212 0.172026 0.012457
C 3.829102 -0.184803 0.333463
C 4.629177 1.086754 0.005339
C -6.440103 0.366638 1.042255
H -2.221905 -1.270895 -1.278791
H -2.165737 0.433296 -1.757797
H -2.574197 -0.591175 1.142863
H -2.436274 1.109346 0.692312
H -0.132330 1.793627 -1.372742
H -0.353151 -2.267020 0.145196
H 2.286087 1.879573 -0.834505
H 2.102770 -2.182670 0.696806
H 4.611241 1.291712 -1.078121
H 4.223967 1.957411 0.547199
H -6.702358 1.272461 0.470186
H -6.827729 0.419330 2.068937
H -6.828168 -0.520049 0.513738


