%chk=000062894.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062894

0 1
 Br   6.570700      0.9641000      -1.247000    
 Cl   4.800700       3.089800      0.6387000    
 O   -2.899600       1.503200      0.9187000    
 O   -1.601100      -1.659800      -1.205000    
 O   0.3398000      0.4423000       1.632400    
 N   -5.303500     -0.1256000      0.2882000    
 N   0.4877000      -1.635800      0.5838000    
 N    2.449700      -2.206600     -0.6676000    
 C   -3.963300     -0.3198000     -0.2877000    
 C   -3.193300       1.010600     -0.3878000    
 C   -3.997600       2.057500      -1.161000    
 C   -5.412500       2.185700     -0.5999000    
 C   -6.091000      0.8214000     -0.5033000    
 C   -3.214500      -1.348400      0.5612000    
 C   -1.843500      -1.668600      1.5000000E-03
 C  -0.8032000      -2.070800       1.026800    
 C   0.9630000     -0.3602000      0.9441000    
 C    2.308900     -1.3200000E-02  0.4321000    
 C    1.273700      -2.475300     -0.2042000    
 C    2.994900     -0.9507000     -0.3518000    
 C    2.880100       1.228900      0.7283000    
 C    4.266200     -0.6231000     -0.8359000    
 C    4.147700       1.539100      0.2381000    
 C    4.840100      0.6153000     -0.5426000    
 H   -4.083100     -0.7297000      -1.299800    
 H   -2.233600      0.8711000     -0.8954000    
 H   -4.052000       1.769600      -2.217900    
 H   -3.502600       3.033900      -1.106100    
 H   -5.384500       2.659600      0.3889000    
 H   -6.003200       2.844900      -1.246300    
 H   -7.076000      0.9371000     -3.7900001E-02
 H   -6.266100      0.4115000      -1.505500    
 H   -5.221200      0.2186000       1.244200    
 H   -3.108600     -0.9850000       1.589900    
 H   -3.770500      -2.292900      0.6067000    
 H   -3.731500       1.597000       1.410500    
 H   -1.030500      -1.610800       1.992900    
 H  -0.8332000      -3.160000       1.133300    
 H   0.8027000      -3.446100     -0.4261000    
 H    2.341200       1.950800       1.337100    
 H    4.802900      -1.348100      -1.445300    


%chk=000062894-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062894

0 1
Br 7.392615 0.030889 -1.340257
Cl 6.617931 1.463808 1.620480
O -4.009310 2.206896 0.881791
O -1.307233 -0.174192 -1.004760
O 1.381809 0.063073 2.363158
N -5.403320 -0.447120 0.314074
N 0.820293 -1.240557 0.487562
N 2.374656 -1.710901 -1.300833
C -4.073388 -0.028065 -0.203333
C -3.980953 1.512245 -0.430858
C -5.125587 1.987924 -1.352534
C -6.516861 1.523549 -0.843443
C -6.516367 -0.005137 -0.567960
C -2.977557 -0.524009 0.756151
C -1.598859 -0.629630 0.130393
C -0.553899 -1.377404 0.989167
C 1.736934 -0.453404 1.262670
C 3.073227 -0.337899 0.653186
C 1.182772 -1.800188 -0.740799
C 3.346153 -0.968291 -0.603909
C 4.084343 0.400546 1.314723
C 4.641786 -0.841524 -1.174286
C 5.355957 0.513691 0.739412
C 5.637589 -0.109379 -0.511415
H -3.935702 -0.511600 -1.191459
H -2.998413 1.765141 -0.862153
H -4.952736 1.569215 -2.363676
H -5.088965 3.089122 -1.449312
H -6.799830 2.065104 0.085436
H -7.292417 1.777782 -1.591179
H -7.472554 -0.323471 -0.114451
H -6.413014 -0.546603 -1.529369
H -5.536001 -0.109154 1.281045
H -2.913225 0.172804 1.620670
H -3.269228 -1.512419 1.167460
H -4.942895 2.460885 1.091385
H -0.560891 -0.977062 2.019728
H -0.841118 -2.446072 1.040332
H 0.396480 -2.357267 -1.257617
H 3.852216 0.874965 2.272721
H 4.835865 -1.324791 -2.134640


