%chk=000063773.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063773

0 1
 Br   6.090800     -0.5981000      0.1649000    
 O  -0.3777000      -2.038400      0.1792000    
 N   4.6599999E-02  0.2787000      0.1836000    
 N   -1.793300       1.783200      7.4600004E-02
 C    1.468800      7.2300002E-02  0.1629000    
 C  -0.5188000       1.556000      0.1625000    
 C   -2.223200     -0.6224000      0.1118000    
 C  -0.7683000     -0.8732000      0.1815000    
 C    2.151700     -1.5799999E-02  -1.044700    
 C   -2.672000      0.6961000      3.6400001E-02
 C    2.147900     -3.7200000E-02   1.371200    
 C   -3.130800      -1.688200      9.5799997E-02
 C    3.532000     -0.2163000      -1.044400    
 C   0.3609000       2.781300      0.3055000    
 C   -4.047400      0.9394000     -5.5300001E-02
 C    1.439200      9.8499998E-02  -2.353500    
 C    3.528300     -0.2376000       1.371400    
 C    4.220400     -0.3272000      0.1636000    
 C   -4.498200      -1.432000      4.8000002E-03
 C   -4.956800     -0.1192000     -7.1900003E-02
 H    1.617800      3.1500001E-02   2.317400    
 H   -2.793800      -2.719600      0.1506000    
 H    4.072600     -0.2863000      -1.985600    
 H    1.090200       2.816400     -0.5079000    
 H   0.8946000       2.741300       1.259100    
 H  -0.2395000       3.695300      0.2765000    
 H   -4.420000       1.959500     -0.1109000    
 H    2.127700      6.0000001E-03  -3.200700    
 H   0.6931000     -0.6960000      -2.456400    
 H   0.9469000       1.071900      -2.443100    
 H    4.049600     -0.3216000       2.321500    
 H   -5.205500      -2.256100     -7.8999996E-03
 H   -6.021800      8.1400000E-02 -0.1427000    


%chk=000063773-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063773

0 1
Br 6.175654 -0.503842 0.318852
O -0.264400 -2.000209 -0.235018
N 0.019552 0.310817 0.096558
N -1.842770 1.833995 0.259664
C 1.463590 0.114161 0.124655
C -0.538172 1.607305 0.232158
C -2.246103 -0.602880 -0.015308
C -0.797652 -0.865457 -0.067731
C 2.179142 -0.086770 -1.086314
C -2.719571 0.737720 0.152156
C 2.119164 0.108964 1.373252
C -3.166242 -1.677856 -0.130028
C 3.582964 -0.266214 -1.003632
C 0.408783 2.779154 0.336167
C -4.120740 0.977223 0.203965
C 1.471728 -0.140647 -2.423989
C 3.516350 -0.072277 1.450019
C 4.229520 -0.253820 0.248276
C -4.546897 -1.426857 -0.075186
C -5.021808 -0.094557 0.092616
H 1.533587 0.231502 2.290392
H -2.767848 -2.689679 -0.257675
H 4.160831 -0.422204 -1.919617
H 1.144607 2.785804 -0.487659
H 0.983670 2.759987 1.279366
H -0.190909 3.699792 0.304258
H -4.462286 2.008784 0.331029
H 2.191926 -0.130325 -3.258485
H 0.873142 -1.067782 -2.495015
H 0.775351 0.707489 -2.557200
H 4.027667 -0.079719 2.416055
H -5.259832 -2.253561 -0.160958
H -6.100001 0.095557 0.134176


