%chk=000018129.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018129

0 1
 Br   3.839900      -1.436200     -1.9999999E-04
 O   -2.882900       1.028200     -3.0000001E-04
 N   -1.388300     -0.7925000      3.0000001E-04
 N   -3.676800      -1.114500     -1.9999999E-04
 C  -0.1304000     -0.1890000      3.0000001E-04
 C    1.021600     -0.9755000      9.9999997E-05
 C  -2.5400000E-02   1.202000      1.9999999E-04
 C    2.278700     -0.3709000     -9.9999997E-05
 C    1.231600       1.806500       0.000000    
 C    2.383600       1.020100     -1.9999999E-04
 C   -2.651600     -0.1782000       0.000000    
 H   0.9371000      -2.060200      1.9999999E-04
 H  -0.8703000       1.876200      3.0000001E-04
 H   -1.389900      -1.809700      3.9999999E-04
 H    1.314600       2.889500       0.000000    
 H    3.355400       1.507000     -3.9999999E-04
 H   -4.649600     -0.8265000     -5.0000002E-04
 H   -3.489400      -2.111400      9.9999997E-05


%chk=000018129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018129

0 1
Br 3.876688 -1.505378 -0.000073
O -2.912940 1.010691 -0.000193
N -1.402772 -0.813039 0.000157
N -3.721182 -1.169982 -0.000030
C -0.151245 -0.142521 0.000074
C 1.015037 -0.959770 0.000035
C -0.018940 1.272754 0.000040
C 2.281197 -0.351161 -0.000028
C 1.271172 1.841983 -0.000029
C 2.442395 1.048323 -0.000062
C -2.686535 -0.233596 0.000092
H 0.929838 -2.052413 0.000053
H -0.916260 1.893289 0.000060
H -1.347999 -1.833266 0.000210
H 1.370502 2.932948 -0.000053
H 3.436515 1.502158 -0.000113
H -4.667272 -0.796887 -0.000231
H -3.590299 -2.179231 0.000090


