%chk=000059860.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059860

0 1
 Br  -3.708300      0.2627000      0.7436000    
 O  -4.6399999E-02  -1.019200     -0.4174000    
 O   -1.889800      -2.299900      5.7500001E-02
 N    2.627800      1.3500000E-02  9.6900001E-02
 C   0.2580000      0.3887000     -0.4290000    
 C    1.395000      0.6280000      0.5637000    
 C   -1.030700       1.021200     -9.4999997E-03
 C   0.6753000      0.7638000      -1.850400    
 C   -1.961000      9.2600003E-02  0.2152000    
 C   -1.166000       2.502600      0.1138000    
 C   -1.343100      -1.214900     -4.2700000E-02
 C    2.458900      -1.433400     -6.1999999E-02
 C    3.730200      0.2943000       1.020300    
 H    1.123500      0.2399000       1.555800    
 H    1.558200       1.707800      0.6725000    
 H  -0.1739000      0.6660000      -2.538700    
 H    1.029600       1.798800      -1.908000    
 H    1.450900      0.1091000      -2.259300    
 H  -0.9237000       2.990700     -0.8351000    
 H  -0.4921000       2.888900      0.8844000    
 H   -2.180400       2.808300      0.3856000    
 H    1.988800      -1.708100      -1.009900    
 H    1.950600      -1.905400      0.7870000    
 H    3.444300      -1.914200     -0.1304000    
 H    3.876500       1.374900       1.128000    
 H    4.672200     -0.1089000      0.6321000    
 H    3.554000     -0.1313000       2.015000    


%chk=000059860-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059860

0 1
Br -3.882395 0.432680 0.649085
O -0.235651 -1.073373 -0.691047
O -2.198535 -2.302560 -0.340269
N 2.591412 -0.180824 0.166994
C 0.197367 0.363074 -0.509400
C 1.307633 0.390541 0.594474
C -1.072279 1.072594 -0.025683
C 0.700917 0.863244 -1.870140
C -2.065053 0.144865 0.084593
C -1.118765 2.542753 0.259627
C -1.601302 -1.216130 -0.310313
C 2.662759 -1.656334 0.261607
C 3.767011 0.482525 0.764825
H 0.886422 -0.110229 1.500844
H 1.474090 1.453292 0.854145
H -0.077407 0.741329 -2.642034
H 0.985227 1.929546 -1.810539
H 1.598973 0.288151 -2.145967
H -0.769147 3.127671 -0.611473
H -0.460070 2.805821 1.110094
H -2.141331 2.867795 0.510320
H 1.803738 -2.106379 -0.258107
H 2.660025 -2.017665 1.319958
H 3.592289 -2.008920 -0.219816
H 3.727677 1.570457 0.576697
H 4.685845 0.091184 0.292301
H 3.858948 0.321393 1.868222


