%chk=000155592.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155592

0 1
 Br   3.095700      -2.646900      0.5774000    
 O   0.2003000      -2.005800       1.291300    
 N  -0.4765000      -1.644500     -0.8956000    
 C    1.872200      -1.459400     -0.3762000    
 C   -1.885400      -1.845400     -0.6699000    
 C    2.304100     -2.7899999E-02 -0.1952000    
 C   -2.588600     -0.5797000     -0.3128000    
 C   0.4675000      -1.742600      0.1205000    
 C    3.205900      0.5315000      -1.089200    
 C    1.793700      0.7109000      0.8628000    
 C   -2.699900     -0.1968000       1.023900    
 C   -3.134800      0.2217000      -1.315500    
 C    3.605800       1.857300     -0.9218000    
 C    2.193500       2.036700       1.030100    
 C   -3.357400      0.9871000       1.358100    
 C   -3.792300       1.405700     -0.9813000    
 C    3.099700       2.609800      0.1378000    
 C   -3.903600       1.788400      0.3556000    
 H    1.955700      -1.760800      -1.426900    
 H   -2.025600      -2.596700      0.1166000    
 H   -2.305000      -2.273700      -1.587600    
 H  -0.1783000      -1.390400      -1.832800    
 H    3.607100     -4.5499999E-02  -1.917600    
 H    1.099500      0.2993000       1.587000    
 H   -2.282400     -0.8118000       1.816300    
 H   -3.053200     -6.4099997E-02  -2.360900    
 H    4.311600       2.303500      -1.616300    
 H    1.802200       2.622200       1.857000    
 H   -3.444400       1.284800       2.398900    
 H   -4.217100       2.030100      -1.761800    
 H    3.411600       3.641900      0.2687000    
 H   -4.415400       2.710200      0.6157000    


%chk=000155592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000155592

0 1
Br 2.472655 -2.317138 -1.529253
O 0.503911 -1.263855 1.322268
N -0.708490 -1.021938 -0.648969
C 1.686150 -0.536655 -0.735272
C -1.987008 -1.468569 -0.067407
C 2.759036 0.243358 -0.036823
C -3.132325 -0.504098 -0.352936
C 0.461987 -0.979040 0.088664
C 3.354839 1.332503 -0.729900
C 3.206295 -0.070475 1.275904
C -2.995056 0.881346 -0.078974
C -4.361223 -0.982869 -0.869167
C 4.369574 2.103220 -0.124324
C 4.221473 0.701969 1.877106
C -4.067585 1.768197 -0.315560
C -5.438463 -0.097069 -1.103388
C 4.806255 1.788482 1.183388
C -5.294041 1.281569 -0.828142
H 1.373214 -0.024958 -1.660039
H -1.800340 -1.562043 1.018813
H -2.239209 -2.479031 -0.445580
H -0.683868 -0.820990 -1.650721
H 3.025469 1.571679 -1.749166
H 2.745457 -0.904061 1.811141
H -2.047834 1.258669 0.324567
H -4.477446 -2.051955 -1.087643
H 4.818711 2.940668 -0.669202
H 4.559370 0.455767 2.889689
H -3.951430 2.835630 -0.096500
H -6.384281 -0.481021 -1.501727
H 5.597120 2.381838 1.655920
H -6.126717 1.969970 -1.010467


