%chk=000104019.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104019

0 1
 Br   1.277500     -0.5361000       2.015800    
 Br  -1.243800      -1.552300      -1.201200    
 Br   5.800000      0.7252000      -1.339100    
 Br  -5.291200       1.451300       1.608900    
 Br   4.969200      -4.561900      0.5151000    
 Br  -6.612700      -3.354800      -1.081400    
 O    2.836800       1.621000      -2.000900    
 O   -3.250800       2.759700     -0.4274000    
 N    3.180500       1.259900      0.2940000    
 N   -2.430200      0.7763000      0.5257000    
 C    1.236300       3.483800      0.4545000    
 C  -1.4600000E-02   2.841900     -0.1597000    
 C    2.443400       3.426100     -0.4839000    
 C   -1.203200       2.840000      0.8036000    
 C    2.840700       1.998400     -0.8323000    
 C   -2.420000       2.132100      0.2236000    
 C    3.595700     -9.1399997E-02  0.3454000    
 C   -3.401000     -0.1825000      0.1525000    
 C    2.854200      -1.021600       1.073900    
 C   -3.032500      -1.283500     -0.6204000    
 C    4.746700     -0.4936000     -0.3321000    
 C   -4.726600     -2.6900001E-02  0.5575000    
 C    3.263700      -2.353900       1.124800    
 C   -3.989700      -2.229000     -0.9886000    
 C    5.156100      -1.826100     -0.2814000    
 C   -5.683800     -0.9723000      0.1896000    
 C    4.414600      -2.756300      0.4471000    
 C   -5.315400      -2.073500     -0.5835000    
 H    1.454700       3.020800       1.421900    
 H    1.019800       4.538000      0.6692000    
 H  -0.2904000       3.374700      -1.078200    
 H   0.1980000       1.808300     -0.4561000    
 H    3.304000       3.916500     -1.4500000E-02
 H    2.225800       3.964500      -1.413400    
 H  -0.9249000       2.358700       1.749000    
 H   -1.495200       3.868100       1.048300    
 H    2.799800       1.591000       1.175600    
 H   -1.510000      0.3787000      0.7069000    
 H    2.687100      -3.081800       1.691600    
 H   -3.705300      -3.089000      -1.591300    
 H    6.053300      -2.143000     -0.8089000    
 H   -6.718600     -0.8536000      0.5038000    


%chk=000104019-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104019

0 1
Br 1.359679 -0.090556 2.429797
Br -0.965318 -0.902947 -1.679349
Br 5.632573 0.317126 -1.554921
Br -4.973723 0.679119 2.277599
Br 4.187535 -4.811734 0.650876
Br -6.139111 -3.499354 -1.524149
O 2.455343 1.313803 -1.913420
O -3.493950 2.678745 0.063328
N 3.215686 1.321170 0.295488
N -2.211818 0.805952 0.644844
C 1.207714 3.684698 0.316909
C -0.079954 2.957845 -0.127838
C 2.391442 3.440237 -0.664376
C -1.212228 3.032366 0.931995
C 2.689504 1.950123 -0.851376
C -2.423724 2.193806 0.514446
C 3.462410 -0.076903 0.380342
C -3.116920 -0.183592 0.173462
C 2.727219 -0.902537 1.275668
C -2.744377 -1.068930 -0.878426
C 4.456714 -0.723837 -0.407211
C -4.415165 -0.358860 0.727838
C 2.929778 -2.290485 1.385639
C -3.610225 -2.058270 -1.382678
C 4.667209 -2.117449 -0.348764
C -5.319751 -1.318289 0.226556
C 3.897874 -2.882992 0.549082
C -4.901201 -2.155649 -0.825612
H 1.484105 3.352381 1.339867
H 1.025103 4.774294 0.384897
H -0.441497 3.387577 -1.081635
H 0.158678 1.898979 -0.344127
H 3.296119 3.967697 -0.304843
H 2.140031 3.837888 -1.661739
H -0.827341 2.681726 1.910952
H -1.557829 4.072379 1.055287
H 3.244874 1.861643 1.163915
H -1.262649 0.495568 0.875828
H 2.343447 -2.889174 2.085362
H -3.291903 -2.716445 -2.193643
H 5.428780 -2.585823 -0.975718
H -6.315137 -1.419396 0.663847


