%chk=000052309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052309

0 1
 Br   2.686000      -2.855400      0.4873000    
 Br   3.870900       2.788200      0.2959000    
 O   -5.983900      0.7517000     -0.2898000    
 O   -5.581300      -1.402200     -0.1573000    
 O    5.161400     -0.5041000      -1.755900    
 N    4.432000     -0.2737000      0.4824000    
 N   -5.187000     -0.2117000     -0.1877000    
 C  -0.3832000      -1.671300      0.2175000    
 C   0.7987000     -0.7251000      0.2532000    
 C   -1.545400     -0.7089000      8.9299999E-02
 C   0.3622000      0.6154000      0.1570000    
 C   -1.081300      0.6254000      5.6100000E-02
 C    2.141300      -1.042200      0.3625000    
 C    1.276400       1.655600      0.1698000    
 C   -2.894300      -1.007500      1.0100000E-02
 C   -1.974000       1.678100     -5.7599999E-02
 C    3.062600      6.5000001E-03  0.3751000    
 C    2.634600       1.341900      0.2797000    
 C   -3.793900      5.3800002E-02 -0.1044000    
 C   -3.338400       1.383200     -0.1378000    
 C    5.336600     -0.4977000     -0.5455000    
 H  -0.4609000      -2.238900       1.149500    
 H  -0.3352000      -2.327700     -0.6564000    
 H   0.9413000       2.685700      9.6000001E-02
 H   -3.211100      -2.045100      3.9099999E-02
 H   -1.637200       2.709000     -8.4600002E-02
 H   -4.028500       2.219400     -0.2266000    
 H    4.792100     -0.3071000       1.433200    
 H    6.336600     -0.6882000     -0.1198000    


%chk=000052309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052309

0 1
Br 2.764857 -2.826655 0.545912
Br 3.914456 2.920269 0.471476
O -6.078612 0.759125 -0.303839
O -5.621576 -1.475873 -0.265193
O 4.835403 -1.346169 -1.557208
N 4.551344 -0.150143 0.457729
N -5.256804 -0.236019 -0.240026
C -0.346123 -1.660249 0.138099
C 0.829259 -0.703158 0.224669
C -1.537367 -0.718583 0.044302
C 0.371179 0.648843 0.193701
C -1.094760 0.641846 0.077942
C 2.199493 -0.974617 0.346294
C 1.276888 1.726021 0.287722
C -2.900019 -1.023674 -0.060045
C -2.020604 1.707927 0.005490
C 3.149906 0.089231 0.387393
C 2.647085 1.425952 0.374661
C -3.808687 0.060155 -0.130476
C -3.393447 1.413278 -0.100453
C 5.299208 -0.823660 -0.517638
H -0.402522 -2.324951 1.021981
H -0.263794 -2.326725 -0.742366
H 0.937573 2.764861 0.280567
H -3.281044 -2.047921 -0.088348
H -1.686443 2.750093 0.028877
H -4.149675 2.199964 -0.160417
H 5.081812 0.374999 1.159775
H 6.380115 -0.837071 -0.250281


