%chk=000038561.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038561

0 1
 Br  -1.819000      0.2125000       2.735500    
 Cl   4.070200      -2.913400      0.8246000    
 N   0.1363000       1.425700     -0.1924000    
 C   0.4944000      0.7020000      -1.406000    
 C    2.002000      0.4633000      -1.506600    
 C    2.567400     -0.3224000     -0.3183000    
 C   -1.315200       1.594800     -0.1020000    
 C   0.8022000       2.729000     -0.1532000    
 C    4.088200     -0.4729000     -0.4302000    
 C   -2.037200      0.2741000     -0.1390000    
 C   0.4902000       3.466400       1.138000    
 C    4.703800      -1.254300      0.7262000    
 C   -2.319500     -0.4322000       1.023500    
 C   -2.415100     -0.2211000      -1.381400    
 C   -2.990200      -1.652600      0.9429000    
 C   -3.085600      -1.441600      -1.461800    
 C   -3.373100      -2.157400     -0.2998000    
 H   6.6600002E-02 -0.3041000      -1.420000    
 H   0.1564000       1.228200      -2.308100    
 H    2.554700       1.396500      -1.659000    
 H    2.184900     -0.1213000      -2.418800    
 H    2.079400      -1.302600     -0.2852000    
 H    2.337400      0.1845000      0.6257000    
 H   -1.678100       2.219400     -0.9324000    
 H   -1.628400       2.137900      0.7930000    
 H   0.5322000       3.354300      -1.013400    
 H    1.890100       2.615900     -0.1578000    
 H    4.339000     -0.9664000      -1.377500    
 H    4.548700      0.5222000     -0.4615000    
 H  -0.5182000       3.890800       1.147500    
 H   0.6158000       2.822300       2.015000    
 H    1.180900       4.309600       1.253600    
 H    4.498000     -0.7626000       1.681900    
 H    5.788800      -1.322400      0.6026000    
 H   -2.216600      0.3286000      -2.297400    
 H   -3.223100      -2.224700       1.837500    
 H   -3.387300      -1.832900      -2.429000    
 H   -3.896000      -3.107200     -0.3626000    


%chk=000038561-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038561

0 1
Br -0.835273 0.341395 2.585628
Cl 3.179677 -3.550942 0.241079
N 0.123974 1.844189 -0.478685
C 0.701013 1.215146 -1.697943
C 2.159810 0.743280 -1.495469
C 2.269918 -0.393948 -0.457338
C -1.353312 1.703770 -0.384722
C 0.568936 3.252767 -0.303387
C 3.729753 -0.794064 -0.161529
C -1.806322 0.260676 -0.208766
C 0.455815 3.767727 1.144105
C 3.878837 -1.900114 0.882013
C -1.636707 -0.483107 0.986316
C -2.448526 -0.405621 -1.287510
C -2.053861 -1.824935 1.106594
C -2.880325 -1.746014 -1.192074
C -2.675743 -2.461052 0.008285
H 0.088262 0.330547 -1.950861
H 0.645466 1.908174 -2.575954
H 2.794883 1.597742 -1.182396
H 2.556645 0.403461 -2.474725
H 1.716688 -1.282411 -0.820780
H 1.769849 -0.066144 0.474408
H -1.867126 2.127988 -1.285672
H -1.687278 2.297980 0.484844
H 0.012648 3.940059 -0.993791
H 1.630342 3.300526 -0.607466
H 4.247577 -1.095745 -1.093356
H 4.278547 0.090651 0.231132
H -0.590910 3.821967 1.492865
H 1.004442 3.098223 1.828380
H 0.883493 4.784877 1.219241
H 3.307327 -1.693207 1.800476
H 4.929729 -2.125202 1.119756
H -2.606520 0.153460 -2.218093
H -1.900538 -2.365121 2.045313
H -3.368670 -2.227333 -2.045908
H -2.997518 -3.503746 0.100092


