%chk=000094107.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094107

0 1
 Br  -4.384200      -1.537500      1.2200000E-02
 O    3.451300       1.061700      0.1268000    
 O    3.465500      -1.331700     -0.1462000    
 O   -1.539700      -2.748100     -0.2002000    
 N   -1.450500       1.218100      0.2569000    
 N   -2.647900      0.5730000      0.2119000    
 C  -0.2118000      0.5663000      0.1536000    
 C  -0.1620000     -0.8356000     -7.8999996E-03
 C    2.195500      0.5363000      9.4899997E-02
 C    1.016700       1.253200      0.2038000    
 C    2.205200     -0.8275000     -6.0699999E-02
 C    1.037100      -1.551800     -0.1168000    
 C   -1.524300       2.661200      0.4244000    
 C   -1.442600      -1.541500     -6.0400002E-02
 C    4.251100     -0.1283000     -2.7899999E-02
 C   -2.676200     -0.7098000      6.5099999E-02
 C   -1.583300       3.341800     -0.9295000    
 H    1.082700       2.329800      0.3120000    
 H    1.056700      -2.628800     -0.2401000    
 H   -2.444500       2.912200      0.9695000    
 H  -0.7197000       3.067000       1.045900    
 H    4.910600     -0.2236000      0.8423000    
 H    4.868400     -2.2000000E-02 -0.9274000    
 H  -0.6784000       3.150700      -1.515300    
 H   -2.439300       2.988300      -1.514200    
 H   -1.682900       4.424700     -0.8053000    


%chk=000094107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094107

0 1
Br -4.432678 -1.588751 0.032907
O 3.489518 1.061332 0.093758
O 3.510882 -1.327775 -0.158257
O -1.540468 -2.891969 -0.169164
N -1.457881 1.222552 0.295724
N -2.662170 0.563532 0.240088
C -0.223502 0.565107 0.167466
C -0.222772 -0.862562 0.011442
C 2.175428 0.560852 0.086732
C 1.008104 1.300815 0.201039
C 2.181990 -0.854521 -0.062756
C 1.007382 -1.582924 -0.105121
C -1.595585 2.696376 0.418025
C -1.489947 -1.627680 -0.039090
C 4.380048 -0.128158 -0.059928
C -2.672467 -0.751116 0.085604
C -1.529101 3.416068 -0.943612
H 1.043856 2.385346 0.305585
H 0.966437 -2.668589 -0.221431
H -2.575880 2.861778 0.890344
H -0.819502 3.068080 1.109582
H 5.014881 -0.212439 0.837403
H 4.956086 -0.020000 -0.993624
H -0.561539 3.255773 -1.450470
H -2.332902 3.054425 -1.607148
H -1.664718 4.502549 -0.797699


