%chk=000269045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269045

0 1
Br -2.996239 5.125063 -0.138254
Br -3.056579 -5.492490 0.443531
O -5.507511 -0.155761 0.174740
O 5.036537 -0.864151 1.594627
O 6.519121 -0.556293 -0.233543
N 0.372641 0.989139 0.035562
C -2.020519 0.538248 0.057171
C -2.034107 -0.934996 0.147966
C -3.369115 1.007717 0.068293
C -3.395678 -1.372936 0.199516
C -4.307167 -0.178389 0.152724
C -0.971389 1.453288 -0.034976
C -3.682893 2.348241 0.011147
C -1.000195 -1.853282 0.195508
C -3.719519 -2.711233 0.287305
C -1.284272 2.841570 -0.090838
C -2.605661 3.258260 -0.063738
C -1.321650 -3.224518 0.286010
C -2.650806 -3.631995 0.326848
C 2.663052 0.856151 -0.681144
C 4.381476 -0.214878 0.556020
C 5.276274 -0.031801 -0.542869
C 1.276976 1.356487 -0.818052
C 3.076484 0.214434 0.518875
C 3.543704 1.034542 -1.754834
C 4.882546 0.588317 -1.708672
C 6.405303 -1.097588 1.127373
H -4.721456 2.688911 0.025517
H 0.043553 -1.532616 0.175476
H -4.760879 -3.040871 0.326047
H -0.469861 3.568162 -0.136515
H -0.511973 -3.957678 0.324750
H 1.107559 2.023236 -1.683049
H 2.387075 0.077331 1.353635
H 3.202035 1.528967 -2.665552
H 5.559381 0.728895 -2.547197
H 6.563795 -2.182697 1.071002
H 7.086060 -0.527082 1.773090


%chk=000269045-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269045

0 1
Br -2.920947 5.141262 -0.492729
Br -3.302858 -5.572609 0.838209
O -5.613020 -0.116999 0.185496
O 5.049613 -1.263115 1.305356
O 6.677879 -0.337783 -0.198545
N 0.356345 0.864198 -0.070353
C -2.059811 0.472754 0.012668
C -2.112576 -0.997318 0.197866
C -3.392216 0.976843 -0.016236
C -3.482668 -1.391483 0.289997
C -4.355084 -0.172720 0.157484
C -0.965075 1.359781 -0.139071
C -3.690195 2.337736 -0.170435
C -1.099022 -1.968253 0.295802
C -3.867794 -2.726597 0.477467
C -1.257516 2.757198 -0.288885
C -2.586919 3.215091 -0.302327
C -1.468787 -3.325515 0.489821
C -2.832270 -3.685874 0.576439
C 2.718727 0.943210 -0.661765
C 4.434988 -0.357513 0.408175
C 5.401347 0.185260 -0.476898
C 1.324306 1.370431 -0.801106
C 3.094067 -0.003991 0.347218
C 3.696037 1.484761 -1.544010
C 5.061325 1.112763 -1.466141
C 6.490872 -1.277726 0.946208
H -4.723874 2.693008 -0.174214
H -0.046722 -1.681699 0.225872
H -4.924069 -3.002600 0.543667
H -0.433341 3.474172 -0.353196
H -0.696878 -4.096427 0.570291
H 1.128360 2.133607 -1.583504
H 2.340089 -0.403450 1.029157
H 3.383778 2.207295 -2.306718
H 5.813521 1.525724 -2.141855
H 6.773915 -2.292828 0.621073
H 7.082576 -0.914889 1.803224


