%chk=000138499.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138499

0 1
 Br  -2.818400       2.006500      6.0000003E-04
 C    2.105800     -8.2599998E-02 -6.0000003E-04
 C   0.6331000     -0.3188000      6.0000003E-04
 C    2.589400      0.6584000       1.261600    
 C    2.587200      0.6612000      -1.262000    
 C  -0.2474000      0.7630000      8.9999998E-04
 C   0.1365000      -1.622400     -1.9999999E-04
 C   -1.624600      0.5412000      3.9999999E-04
 C   -1.240500      -1.844200     -6.9999998E-04
 C   -2.121100     -0.7624000     -5.0000002E-04
 H    2.618400      -1.054500     -2.2000000E-03
 H    2.190200       1.677000       1.315400    
 H    3.682600      0.7273000       1.271200    
 H    2.277400      0.1272000       2.167600    
 H    2.273300      0.1322000      -2.168700    
 H    3.680300      0.7296000      -1.273600    
 H    2.188300       1.680100      -1.312800    
 H   0.1343000       1.781100      1.3000000E-03
 H   0.8082000      -2.476700     -6.9999998E-04
 H   -1.627100      -2.859100     -1.4000000E-03
 H   -3.191200     -0.9526000     -8.9999998E-04


%chk=000138499-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138499

0 1
Br -2.874086 2.063216 0.001938
C 2.160103 -0.088226 -0.000890
C 0.649846 -0.330434 -0.000574
C 2.620310 0.664083 1.277505
C 2.619451 0.666669 -1.278056
C -0.255306 0.764553 0.000324
C 0.120865 -1.646201 -0.001025
C -1.643728 0.528551 0.000697
C -1.276241 -1.867013 -0.000644
C -2.176902 -0.777983 0.000209
H 2.655469 -1.080563 -0.002058
H 2.174484 1.675236 1.328637
H 3.720153 0.779774 1.280498
H 2.325626 0.118192 2.192250
H 2.323966 0.122749 -2.193717
H 3.719319 0.782131 -1.281638
H 2.173821 1.678028 -1.326748
H 0.122613 1.792943 0.000762
H 0.806613 -2.502095 -0.001642
H -1.672993 -2.888250 -0.001009
H -3.258682 -0.943862 0.000481


