%chk=000066492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066492

0 1
 Br -4.3400001E-02   4.401800      8.9999998E-04
 O   -2.114600       2.469500     -2.4000001E-03
 O    2.720400      -3.341800     -1.4000000E-03
 N    2.846100      -1.017100      3.0000001E-04
 C   0.7328000      0.2126000      9.9999997E-05
 C  -2.5699999E-02  -1.054000     -3.0000001E-04
 C    2.138700      0.2237000      5.0000002E-04
 C   3.1300001E-02   1.429300     -3.9999999E-04
 C   -1.516700      -1.069500       0.000000    
 C   -2.198200      0.1613000       0.000000    
 C   -1.449700       1.441900     -1.4000000E-03
 C   0.6903000      -2.191100     -3.9999999E-04
 C    2.176900      -2.236400     -5.0000002E-04
 C    2.812300       1.457300      7.9999998E-04
 C   0.7160000       2.648900     -9.9999997E-05
 C   -2.292900      -2.242700      1.9999999E-04
 C    2.105200       2.658700      5.0000002E-04
 C   -3.601300      0.2119000      6.9999998E-04
 C    4.306500      -1.009600      1.0000000E-03
 C   -3.690300      -2.190300      6.9999998E-04
 C   -4.343800     -0.9646000      1.3000000E-03
 H   0.2328000      -3.174100     -6.0000003E-04
 H    3.896900       1.517400      1.1000000E-03
 H   -1.841600      -3.230400      9.9999997E-05
 H    2.670600       3.587900      7.9999998E-04
 H   -4.138400       1.156700      7.9999998E-04
 H    4.669500     -0.5038000     -0.8992000    
 H    4.710500      -2.026100      1.1000000E-03
 H    4.668700     -0.5039000      0.9016000    
 H   -4.265500      -3.111900      1.0000000E-03
 H   -5.428900     -0.9248000      1.9000000E-03


%chk=000066492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066492

0 1
Br 0.001093 4.511341 0.000853
O -2.202491 2.579102 -0.001312
O 2.814323 -3.357182 -0.000295
N 2.817736 -1.001431 0.000193
C 0.679593 0.243512 0.000043
C -0.034090 -1.032236 -0.000071
C 2.118320 0.214574 0.000272
C -0.019507 1.506774 -0.000025
C -1.512572 -1.048714 0.000131
C -2.222178 0.185477 -0.000118
C -1.521648 1.505558 -0.000740
C 0.702960 -2.206087 -0.000215
C 2.155847 -2.266385 -0.000238
C 2.838372 1.440381 0.000596
C 0.745324 2.704052 0.000433
C -2.261846 -2.258837 0.000595
C 2.158453 2.662161 0.000743
C -3.641815 0.197206 0.000099
C 4.295987 -1.024331 0.000495
C -3.667710 -2.239972 0.000829
C -4.366381 -1.005421 0.000589
H 0.228818 -3.189171 -0.000323
H 3.929747 1.445246 0.000752
H -1.751766 -3.225899 0.000820
H 2.723435 3.598346 0.001077
H -4.141549 1.170525 -0.000163
H 4.698104 -0.531007 -0.901818
H 4.595903 -2.083300 0.000466
H 4.697716 -0.531112 0.903033
H -4.222570 -3.184342 0.001211
H -5.461108 -0.992024 0.000789


