%chk=000038547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038547

0 1
 Br   2.584200     -0.8416000       2.603000    
 Cl  -3.834200      -2.772400      -1.127100    
 N   -1.026700      0.4688000      0.4511000    
 C   -2.295700      0.2705000       1.150600    
 C  -0.4901000       1.799600      0.7331000    
 C  -6.4199999E-02 -0.5626000      0.8365000    
 C   -2.897500      -1.085500      0.7851000    
 C   -1.482800       2.874400      0.2975000    
 C    1.235400     -0.4245000      8.9100003E-02
 C   -3.149100      -1.183600     -0.7145000    
 C   -1.789800       2.775200      -1.188800    
 C    2.459900     -0.5247000      0.7372000    
 C    1.172200     -0.1915000      -1.279600    
 C    3.640100     -0.3898000      5.9000002E-03
 C    2.352300     -5.6600001E-02  -2.010900    
 C    3.586300     -0.1557000      -1.368200    
 H   -2.170900      0.3344000       2.239300    
 H   -3.051800       1.008200      0.8684000    
 H  -0.2787000       1.922800       1.803800    
 H   0.4480000       1.995500      0.2027000    
 H  -0.4108000      -1.567600      0.5739000    
 H   5.1600002E-02 -0.5459000       1.922700    
 H   -2.304600      -1.927900       1.155000    
 H   -3.861200      -1.171600       1.305900    
 H   -2.399900       2.897500      0.8930000    
 H   -1.010600       3.849700      0.4761000    
 H   -2.231100      -1.081500      -1.298700    
 H   -3.859400     -0.4206000      -1.047600    
 H  -0.8714000       2.782000      -1.785000    
 H   -2.354600       1.871300      -1.434700    
 H   -2.394800       3.633000      -1.500600    
 H   0.2251000     -0.1266000      -1.808100    
 H    4.610900     -0.4641000      0.4892000    
 H    2.310600      0.1220000      -3.081400    
 H    4.505000     -5.1399998E-02  -1.937900    


%chk=000038547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038547

0 1
Br 2.912764 -1.266891 2.524826
Cl -3.787550 -2.743747 -1.499101
N -1.042855 0.540564 0.714134
C -2.334747 0.084914 1.296686
C -0.787789 1.995180 0.937186
C 0.101210 -0.272836 1.197517
C -2.855558 -1.242582 0.693912
C -1.710641 2.946565 0.142867
C 1.298051 -0.288184 0.248131
C -3.065896 -1.128799 -0.816170
C -1.598882 2.791912 -1.388226
C 2.589788 -0.701200 0.656033
C 1.144102 0.070961 -1.116428
C 3.687883 -0.751828 -0.226795
C 2.224569 0.027784 -2.021781
C 3.502069 -0.381707 -1.578004
H -2.268307 -0.028361 2.408296
H -3.086306 0.872377 1.106973
H -0.855616 2.241992 2.027936
H 0.257547 2.190189 0.632162
H -0.238983 -1.317438 1.332927
H 0.438719 0.065539 2.206762
H -2.162258 -2.077424 0.904907
H -3.813754 -1.495271 1.185929
H -2.765612 2.814675 0.454560
H -1.439521 3.981506 0.432700
H -2.123740 -0.973307 -1.358672
H -3.797873 -0.350443 -1.082874
H -0.563756 2.981218 -1.729320
H -1.875580 1.769383 -1.701146
H -2.264047 3.504247 -1.909617
H 0.145057 0.385481 -1.434449
H 4.668402 -1.077120 0.132537
H 2.070408 0.310309 -3.068777
H 4.350405 -0.418457 -2.269620


