%chk=000142878.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142878

0 1
 Br   7.516800      0.7696000     -0.3925000    
 O   -1.397300     -0.7955000      0.6213000    
 C    2.206100      0.2542000      0.1881000    
 C    3.493500     -0.5464000     -1.8100001E-02
 C   0.9884000     -0.6689000      0.2909000    
 C    4.715100      0.3711000     -8.7800004E-02
 C  -0.3036000      0.1052000      0.5229000    
 C    5.992900     -0.4339000     -0.2518000    
 C   -2.625900     -0.3216000      0.2399000    
 C   -2.916900       1.029800      0.3847000    
 C   -3.567200      -1.198000     -0.2871000    
 C   -4.167100       1.511600     -2.9000000E-03
 C   -4.817400     -0.7161000     -0.6748000    
 C   -5.117300      0.6388000     -0.5327000    
 H    2.068900      0.9530000     -0.6458000    
 H    2.288000      0.8531000       1.103100    
 H    3.419000      -1.132200     -0.9424000    
 H    3.617600      -1.258400      0.8071000    
 H   0.8916000      -1.269200     -0.6224000    
 H    1.127700      -1.388100       1.107700    
 H    4.598800       1.069500     -0.9262000    
 H    4.772200      0.9792000      0.8238000    
 H  -0.4279000      0.7992000     -0.3189000    
 H  -0.2284000      0.6779000       1.454800    
 H    5.985100      -1.033100      -1.166400    
 H    6.182700      -1.081700      0.6083000    
 H   -2.216500       1.737100      0.8179000    
 H   -3.337400      -2.253800     -0.3993000    
 H   -4.403600       2.565300      0.1135000    
 H   -5.557600      -1.395700      -1.087000    
 H   -6.091400       1.013700     -0.8331000    


%chk=000142878-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142878

0 1
Br 7.799435 0.688524 0.167732
O -1.375312 -0.756714 -0.132045
C 2.291267 0.263877 0.072193
C 3.600880 -0.554523 -0.007236
C 1.032583 -0.623385 -0.058823
C 4.860305 0.343826 0.105025
C -0.259943 0.191373 0.033017
C 6.141165 -0.487857 0.022519
C -2.684412 -0.247161 -0.089796
C -3.007651 1.118075 0.114632
C -3.713180 -1.206125 -0.269717
C -4.366961 1.510714 0.137485
C -5.060921 -0.798346 -0.244822
C -5.398157 0.563208 -0.040870
H 2.292280 1.030905 -0.729654
H 2.263851 0.814868 1.035045
H 3.624439 -1.114003 -0.964894
H 3.608070 -1.312597 0.802541
H 1.045857 -1.159982 -1.026844
H 1.025292 -1.393631 0.735999
H 4.853958 1.096744 -0.705705
H 4.838776 0.899079 1.061877
H -0.302723 0.961567 -0.766088
H -0.341317 0.698794 1.017616
H 6.253988 -1.003545 -0.944066
H 6.239757 -1.205174 0.852351
H -2.226117 1.870679 0.254735
H -3.433207 -2.252478 -0.426581
H -4.614690 2.566499 0.296540
H -5.851294 -1.544269 -0.385356
H -6.447118 0.876759 -0.022010


