%chk=000270399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270399

0 1
Br -5.209335 -1.645985 2.299445
O 1.366675 -0.103884 0.131589
O -4.854531 -0.667724 -1.043381
O 1.907698 0.237500 -2.060367
C -2.788622 -0.282002 0.034573
C -5.059714 0.018064 1.235733
C -4.273073 -0.357955 -0.027127
C -2.063378 -0.282675 1.239361
C -2.098059 -0.229865 -1.190725
C -0.015087 -0.149815 -0.015418
C -0.674261 -0.215091 1.227171
C -0.705847 -0.155503 -1.229632
C -6.432423 0.554761 0.900418
C 3.646151 0.042524 -0.379036
C 2.272468 0.078053 -0.925691
C 4.708070 0.280728 -1.269552
C 3.902191 -0.221245 0.975304
C 6.021791 0.254868 -0.799553
C 5.220358 -0.245485 1.436704
C 6.277527 -0.007844 0.551572
H -4.499578 0.736271 1.875025
H -2.578403 -0.347194 2.200476
H -2.669434 -0.251666 -2.126226
H -0.094867 -0.217449 2.148019
H -0.176468 -0.104962 -2.185614
H -7.051345 0.706895 1.794072
H -6.981733 -0.129904 0.230614
H -6.364317 1.517821 0.373800
H 4.496680 0.483555 -2.323311
H 3.069361 -0.406152 1.659219
H 6.848178 0.438814 -1.485728
H 5.424071 -0.450291 2.487326
H 7.305755 -0.027663 0.915340


%chk=000270399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270399

0 1
Br -5.150074 -1.924399 2.087191
O 1.391137 -0.046732 0.156788
O -4.941389 -0.239275 -1.189928
O 2.032851 0.159738 -2.103796
C -2.846262 -0.134502 -0.002194
C -5.171520 -0.048635 1.215400
C -4.339908 -0.161874 -0.078447
C -2.123276 -0.091677 1.223146
C -2.116359 -0.143845 -1.221877
C -0.017290 -0.063955 -0.009455
C -0.719627 -0.058825 1.219905
C -0.710320 -0.106331 -1.246799
C -6.616015 0.377165 0.981979
C 3.725974 0.010460 -0.356868
C 2.340003 0.051578 -0.896444
C 4.793178 0.122016 -1.288301
C 4.006808 -0.137564 1.027426
C 6.127760 0.086573 -0.838801
C 5.345036 -0.173297 1.471099
C 6.406399 -0.061181 0.541479
H -4.670494 0.571535 1.975513
H -2.644946 -0.112039 2.184570
H -2.682058 -0.180414 -2.158601
H -0.149516 -0.035484 2.152941
H -0.164604 -0.105065 -2.189935
H -7.188220 0.358220 1.923684
H -7.100696 -0.275720 0.239768
H -6.629451 1.408605 0.579075
H 4.554136 0.234557 -2.350882
H 3.179664 -0.224732 1.736351
H 6.948796 0.172909 -1.558209
H 5.562105 -0.288967 2.538270
H 7.444674 -0.089342 0.890353


