%chk=000047238.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047238

0 1
 Br   2.987800      -1.907500     -0.9211000    
 Cl  -2.535300       1.988100      0.6629000    
 Cl  -4.247700     -0.3568000      0.5236000    
 Cl  -2.731800      0.4935000      -1.811400    
 O  -0.2751000      8.8200003E-02 -2.1100000E-02
 O    1.030800      -1.221100       1.352100    
 C    2.869700      0.9204000     -0.3620000    
 C    1.946200     -0.2609000     -0.6951000    
 C   -1.487400     -0.5316000      0.4191000    
 C    3.667600      0.7459000      0.9351000    
 C    2.075700       2.229600     -0.2982000    
 C   0.8790000     -0.5498000      0.3400000    
 C   -2.686200      0.3321000     -2.4599999E-02
 C   -1.493400      -1.970000     -9.9399999E-02
 H    3.598200       1.022200      -1.178000    
 H    1.473600     -0.1236000      -1.674400    
 H   -1.478900     -0.5602000       1.517800    
 H    4.296800       1.625300       1.114300    
 H    4.336900     -0.1178000      0.8985000    
 H    3.009600      0.6339000       1.802900    
 H    2.752300       3.084900     -0.1944000    
 H    1.493200       2.377600      -1.213700    
 H    1.387500       2.246800      0.5533000    
 H   -2.454500      -2.462400      7.3600002E-02
 H   -1.273200      -2.009800      -1.172000    
 H  -0.7409000      -2.592800      0.3936000    


%chk=000047238-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000047238

0 1
Br 2.872642 -1.746044 -1.268971
Cl -2.199633 1.939126 -0.049554
Cl -4.231555 -0.165041 0.710356
Cl -3.045978 -0.143494 -2.076345
O -0.343976 -0.418329 -0.533454
O 0.928449 -0.464640 1.428158
C 3.007605 1.076080 -0.273408
C 1.980611 0.039011 -0.775868
C -1.561554 -0.770361 0.246177
C 3.808367 0.662399 0.980383
C 2.265179 2.424779 -0.047791
C 0.856939 -0.309413 0.191977
C -2.680063 0.152310 -0.282832
C -1.821198 -2.273081 0.092693
H 3.720191 1.213876 -1.111530
H 1.537737 0.349745 -1.734350
H -1.385278 -0.506524 1.306937
H 4.550708 1.446483 1.215864
H 4.350794 -0.284297 0.814434
H 3.146583 0.530158 1.851959
H 3.002157 3.211912 0.190433
H 1.700949 2.745215 -0.943118
H 1.561557 2.355071 0.801574
H -2.736270 -2.572113 0.629944
H -1.916481 -2.548624 -0.969946
H -0.967984 -2.820004 0.527677


