%chk=000046381.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046381

0 1
 Br   3.410700      -1.692200      3.0000001E-04
 Cl   3.264500       1.640000       0.000000    
 O   -1.849300      -1.115400     -3.9999999E-04
 N   -1.916100       1.150100       0.000000    
 N   -3.936600     -0.1558000      9.9999997E-05
 C  -0.5632000     -0.6565000       0.000000    
 C  -0.6080000      0.7299000      9.9999997E-05
 C   0.6035000      -1.410900       0.000000    
 C   0.5970000       1.446900     -9.9999997E-05
 C    1.796800     -0.6805000     -9.9999997E-05
 C    1.796300      0.7198000     -1.9999999E-04
 C   -2.595700      2.4499999E-02  3.0000001E-04
 H   0.5739000      -2.494100     -9.9999997E-05
 H   0.5884000       2.532600     -9.9999997E-05
 H   -4.352400      -1.081400      9.9999997E-05
 H   -4.582100      0.6270000       0.000000    


%chk=000046381-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000046381

0 1
Br 3.510325 -1.683473 0.000000
Cl 3.347475 1.684311 -0.000016
O -1.893528 -1.180770 -0.000030
N -1.959865 1.159818 -0.000041
N -4.014378 -0.136586 0.000023
C -0.554059 -0.701131 -0.000018
C -0.607510 0.724413 -0.000039
C 0.625477 -1.441856 -0.000011
C 0.593187 1.456264 -0.000033
C 1.829132 -0.691968 -0.000007
C 1.804813 0.729048 -0.000019
C -2.661823 0.028139 0.000014
H 0.638181 -2.533488 -0.000002
H 0.596012 2.548397 -0.000040
H -4.421081 -1.067304 0.000125
H -4.604659 0.690187 -0.000004


