%chk=000184417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184417

0 1
Br 1.197622 3.983945 0.253009
Br 4.057951 2.076710 -0.513469
O -0.110605 1.290028 1.711782
O -1.636079 -3.070867 1.714534
O -2.691346 -3.025711 -0.251925
C 1.191895 2.062296 -0.148043
C 2.440513 1.368295 0.389589
C -1.191333 1.182585 -0.413429
C -0.072308 1.491836 0.522580
C -1.743782 -0.115809 -0.474148
C 2.381007 -0.119718 0.177516
C -1.179084 -1.183201 0.420081
C -1.706765 2.206139 -1.221350
C -2.783094 -0.367899 -1.379651
C 2.358628 -0.968515 1.294589
C 2.338676 -0.667346 -1.114622
C -2.757026 1.946537 -2.102643
C -3.288424 0.655597 -2.183983
C 2.285218 -2.353524 1.118622
C 2.263257 -2.051346 -1.283760
C 2.235397 -2.896451 -0.168545
C -1.939642 -2.467261 0.511692
H 1.134129 1.978586 -1.260535
H 2.584748 1.618538 1.473726
H -1.049840 -0.770267 1.462440
H -0.130560 -1.426687 0.098809
H -1.295181 3.215841 -1.156304
H -3.211574 -1.374544 -1.462978
H 2.393925 -0.552324 2.302647
H 2.383140 -0.016155 -1.988400
H -3.159412 2.745790 -2.723331
H -4.103789 0.443707 -2.877485
H 2.268581 -3.009298 1.989336
H 2.234437 -2.474409 -2.287799
H 2.182859 -3.976165 -0.304162
H -2.102339 -3.941632 1.835208


%chk=000184417-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184417

0 1
Br 0.914151 3.924811 0.521927
Br 4.097649 2.489636 -0.247561
O 0.019470 0.771182 1.646564
O -2.725017 -3.029679 2.051111
O -2.882103 -3.063236 -0.259503
C 1.189581 1.994338 -0.088560
C 2.497077 1.405170 0.461971
C -1.202515 0.985353 -0.444947
C -0.034629 1.211750 0.459882
C -2.124032 -0.099678 -0.231272
C 2.674662 -0.052054 0.090576
C -1.962138 -1.063571 0.936454
C -1.415803 1.883028 -1.531883
C -3.216224 -0.232067 -1.124598
C 2.934420 -0.996565 1.115889
C 2.566041 -0.500630 -1.252350
C -2.517168 1.741398 -2.392864
C -3.419932 0.674541 -2.186187
C 3.077494 -2.366954 0.806541
C 2.705064 -1.870181 -1.560316
C 2.960168 -2.808056 -0.531880
C -2.576570 -2.443798 0.782843
H 1.205777 2.059917 -1.185154
H 2.549543 1.551024 1.550064
H -2.357464 -0.613590 1.865765
H -0.892595 -1.220156 1.172221
H -0.741232 2.732732 -1.675920
H -3.909403 -1.067007 -0.999887
H 3.014106 -0.656792 2.154699
H 2.402859 0.220974 -2.061390
H -2.673968 2.454396 -3.208575
H -4.281206 0.544478 -2.850467
H 3.278786 -3.087020 1.607039
H 2.620320 -2.206371 -2.599326
H 3.070816 -3.870986 -0.772740
H -3.066181 -3.959036 1.941434


