%chk=000178339.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178339

0 1
 Br   1.666100       3.067500     -7.8800000E-02
 Cl   1.963800      -2.476900     -0.6591000    
 Cl   4.854000      -1.291600       1.057600    
 O  -0.6373000      2.3100000E-02 -0.1771000    
 N    1.660000      0.1758000     -0.4681000    
 N    3.436700      0.9539000      0.5948000    
 C   -2.970700     -0.1279000      0.3387000    
 C   -4.392300     -9.9699996E-02 -0.2184000    
 C   -1.932500      4.3499999E-02 -0.7610000    
 C   -5.429300     -0.2300000      0.8969000    
 C   0.3781000      0.1795000      -1.158900    
 C   -6.846500     -0.1682000      0.3497000    
 C    2.428200     -0.9144000     -0.1987000    
 C    2.297500       1.274400      2.2399999E-02
 C    3.524400     -0.4090000      0.4600000    
 H   -2.788600      -1.071300      0.8684000    
 H   -2.839700      0.6653000       1.085500    
 H   -4.521900     -0.9155000     -0.9399000    
 H   -4.554700      0.8398000     -0.7606000    
 H   -2.085400      0.9985000      -1.277300    
 H   -2.018600     -0.7706000      -1.490100    
 H   -5.288100      -1.178800       1.427300    
 H   -5.292900      0.5747000       1.628800    
 H   0.2657000       1.124300      -1.699500    
 H   0.3558000     -0.6384000      -1.885700    
 H   -7.030200      0.7842000     -0.1577000    
 H   -7.027000     -0.9785000     -0.3639000    
 H   -7.571600     -0.2647000       1.163800    


%chk=000178339-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178339

0 1
Br 1.937588 3.126220 -0.179669
Cl 1.861403 -2.556299 -0.643728
Cl 4.781808 -1.545306 1.274848
O -0.616658 0.165622 -0.221858
N 1.715941 0.235980 -0.540199
N 3.539581 0.867063 0.666077
C -2.976313 -0.028635 0.301315
C -4.432473 -0.085381 -0.215626
C -1.961914 0.122951 -0.834008
C -5.462721 -0.248335 0.925508
C 0.434092 0.296041 -1.223285
C -6.918356 -0.307298 0.415392
C 2.413366 -0.937780 -0.171029
C 2.454017 1.287720 0.013821
C 3.519523 -0.520335 0.556446
H -2.739320 -0.948921 0.868618
H -2.854926 0.819985 1.001401
H -4.544397 -0.929282 -0.928427
H -4.664814 0.838727 -0.785305
H -2.144360 1.060078 -1.406071
H -2.023045 -0.735919 -1.539593
H -5.230512 -1.170475 1.495715
H -5.352577 0.593832 1.638419
H 0.366385 1.267799 -1.753794
H 0.384657 -0.532272 -1.960049
H -7.184633 0.615115 -0.134519
H -7.064873 -1.161869 -0.271891
H -7.633471 -0.420028 1.250593


