%chk=000053423.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053423

0 1
 Br   5.690300     -0.6346000      8.9999998E-04
 O   -2.319300       1.024300     -1.2000001E-03
 O   -4.412900      -1.774900      3.1999999E-03
 O   -4.853100      0.3758000       0.000000    
 N   -4.013800     -0.5729000      5.0000002E-04
 C  -0.4043000     -0.1806000     -6.9999998E-04
 C    1.012000     -0.3007000     -3.9999999E-04
 C    1.798900      0.8816000      5.0000002E-04
 C  -0.9587000       1.095700     -6.0000003E-04
 C   -1.514200      -1.073300     -1.2000001E-03
 C    1.174900       2.140300      7.9999998E-04
 C  -0.2171000       2.273900      3.0000001E-04
 C    1.635700      -1.564200     -1.1000000E-03
 C   -2.646200     -0.2930000     -1.5000000E-03
 C    3.197000      0.7585000      1.0000000E-03
 C    3.026800      -1.656100     -7.9999998E-04
 C    3.804000     -0.4997000      3.9999999E-04
 H   -1.485100      -2.154300     -7.9999998E-04
 H    1.777200       3.047800      1.4000000E-03
 H  -0.6919000       3.248200      5.0000002E-04
 H    1.049800      -2.479900     -2.0000001E-03
 H    3.815800       1.654700      1.8000000E-03
 H    3.489900      -2.639600     -1.4000000E-03


%chk=000053423-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053423

0 1
Br 5.776613 -0.666033 -0.000076
O -2.376095 1.113835 0.000221
O -4.324206 -1.902374 -0.000413
O -4.967369 0.307149 -0.000110
N -4.075610 -0.626832 -0.000489
C -0.429431 -0.154024 -0.000103
C 1.000461 -0.325842 -0.000115
C 1.807292 0.877053 0.000258
C -0.969708 1.159187 0.000275
C -1.551836 -1.057081 -0.000374
C 1.185426 2.182577 0.000629
C -0.201183 2.345741 0.000646
C 1.644857 -1.597707 -0.000462
C -2.686153 -0.257861 -0.000236
C 3.234076 0.757787 0.000264
C 3.041341 -1.697407 -0.000452
C 3.822982 -0.507140 -0.000087
H -1.557155 -2.143882 -0.000696
H 1.832969 3.066070 0.000905
H -0.676570 3.329199 0.000926
H 1.043108 -2.512637 -0.000738
H 3.850639 1.661905 0.000544
H 3.531252 -2.674681 -0.000717


