%chk=000032626.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032626

0 1
 Br   5.381700       1.456000     -0.3301000    
 Cl -0.2696000      -3.409600       1.421600    
 Cl  -2.447300      -2.754700     -0.3492000    
 Cl  0.1685000      -3.239000      -1.467000    
 N   -1.774500       2.161700      3.7799999E-02
 N   0.4627000       1.523000      0.3307000    
 N    1.031900     -0.8075000      0.2801000    
 N   -1.248700     -0.1228000     -1.6100001E-02
 C    2.758300      0.8420000      0.6293000    
 C    1.326500      0.4973000      0.3987000    
 C  -0.8238000       1.155800      0.1201000    
 C   -3.179300       1.920600     -0.1830000    
 C  -0.2741000      -1.042000      7.4199997E-02
 C    3.509800       1.054000     -0.6815000    
 C   -3.938600       3.233500     -0.1968000    
 C  -0.6836000      -2.468200     -6.8700001E-02
 H    3.232400      4.1700002E-02   1.211700    
 H    2.819500       1.745200       1.249500    
 H   -3.328500       1.408100      -1.140200    
 H   -3.582900       1.281600      0.6107000    
 H   -1.440200       3.113300      0.1399000    
 H    3.495800      0.1590000      -1.310900    
 H    3.108300       1.896800      -1.252000    
 H   -3.824500       3.764000      0.7546000    
 H   -3.572600       3.891300     -0.9924000    
 H   -5.005500       3.056100     -0.3635000    


%chk=000032626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032626

0 1
Br 5.663158 0.866531 0.189877
Cl 0.159864 -3.316995 0.851389
Cl -2.308288 -2.674489 -0.759770
Cl 0.368319 -2.827955 -2.136289
N -1.931756 2.238684 0.179184
N 0.369617 1.785789 0.182369
N 1.094840 -0.493338 -0.196909
N -1.275150 0.009877 -0.189982
C 2.774055 1.289387 0.184093
C 1.335059 0.838204 0.049298
C -0.928580 1.330527 0.055709
C -3.367333 1.905263 0.072087
C -0.224085 -0.826446 -0.303988
C 3.774056 0.144868 -0.004608
C -4.214490 3.186088 0.126109
C -0.508962 -2.311776 -0.573334
H 2.901821 1.758429 1.177707
H 2.958469 2.094541 -0.551264
H -3.537303 1.356973 -0.872046
H -3.644749 1.214884 0.890977
H -1.645815 3.202063 0.368002
H 3.678930 -0.638945 0.758292
H 3.731228 -0.301149 -1.007103
H -4.068704 3.728567 1.078584
H -3.967814 3.867203 -0.708526
H -5.284685 2.930416 0.047643


