%chk=000005034.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005034

0 1
 I    5.860700       2.651500     -6.0000001E-03
 Br  -4.432700      0.2202000       2.871600    
 Br  -4.433400      0.2023000      -2.871900    
 O  -0.4344000      -2.108200      5.5000000E-03
 O   -5.574300      4.8000000E-02  8.9999998E-04
 N    1.927300      -2.164200      5.5999998E-03
 C    2.386900      8.9100003E-02 -1.1000000E-03
 C   0.9402000     -9.9200003E-02 -5.0000002E-04
 C    2.937600      -1.195900      2.7999999E-03
 C   0.6593000      -1.574000      3.8999999E-03
 C  -1.9200001E-02  0.8283000     -3.1000001E-03
 C    3.201200       1.205700     -3.5000001E-03
 C   -1.449600      0.6284000     -2.4000001E-03
 C    4.300900      -1.416000      4.0000002E-03
 C    4.585900       1.005400     -2.3000001E-03
 C    5.130300     -0.2927000      1.4000000E-03
 C   -2.150800      0.5265000      -1.209700    
 C   -2.149900      0.5335000       1.206200    
 C   -3.531400      0.3397000       1.207400    
 C   -3.532200      0.3325000      -1.208600    
 C   -4.222500      0.2392000     -9.9999997E-05
 H    2.107600      -3.161300      8.7000001E-03
 H   0.2683000       1.878600     -6.2000002E-03
 H    2.772500       2.202700     -6.3000000E-03
 H    4.718600      -2.416300      7.0000002E-03
 H    6.207700     -0.4430000      2.4000001E-03
 H   -1.610900      0.5996000      -2.152300    
 H   -1.609400      0.6122000       2.148000    
 H   -5.879200      7.7000000E-03  0.9238000    


%chk=000005034-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005034

0 1
I 5.533280 2.385361 -1.906394
Br -4.713279 -1.816872 1.552317
Br -4.541311 2.961256 -1.737796
O -0.078903 -2.235338 1.556931
O -5.753202 0.666337 -0.085939
N 2.246951 -1.997994 1.265829
C 2.399424 -0.111037 -0.035861
C 0.965299 -0.361969 0.213835
C 3.152795 -1.130617 0.622421
C 0.908063 -1.605013 1.070896
C -0.053544 0.434350 -0.277205
C 3.072384 0.894099 -0.760567
C -1.508039 0.404888 -0.170719
C 4.555197 -1.171412 0.574297
C 4.484607 0.855135 -0.808678
C 5.226443 -0.157780 -0.155566
C -2.218208 1.449391 -0.845096
C -2.265040 -0.573321 0.547452
C -3.657121 -0.477338 0.567830
C -3.615201 1.522989 -0.808291
C -4.377643 0.556991 -0.097114
H 2.491142 -2.820157 1.816779
H 0.303544 1.282901 -0.882415
H 2.523658 1.687956 -1.275502
H 5.130031 -1.954189 1.079147
H 6.318510 -0.163779 -0.210531
H -1.661679 2.209999 -1.402402
H -1.738729 -1.380599 1.069301
H -6.154328 -0.073940 0.448240


