%chk=000125820.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125820

0 1
 Br -0.1174000       4.773400     -0.7067000    
 Cl  -1.178900      -1.322200       2.361400    
 O    2.152600      -2.956200      -1.786900    
 O    3.010000      -2.729000      0.6852000    
 N    2.524300     -0.5035000      0.8443000    
 N   0.3241000      -1.668300     -0.8530000    
 C   0.6110000      0.6943000     -0.2031000    
 C  -0.1767000     -0.5488000     -0.4566000    
 C    1.831600      0.6724000      0.4898000    
 C   -1.646900     -0.5278000     -0.2068000    
 C    1.747700      -1.760300      -1.124200    
 C   4.5800000E-02   1.925400     -0.5746000    
 C    2.455600      -1.731600      0.2195000    
 C    2.411000       1.885300      0.8913000    
 C   0.6596000       3.123400     -0.2111000    
 C    1.832100       3.103700      0.5364000    
 C   -2.181800     -0.8609000       1.033200    
 C   -2.478200     -0.1602000      -1.260000    
 C   -3.563400     -0.8258000       1.222200    
 C   -3.859800     -0.1252000      -1.070700    
 C   -4.402400     -0.4581000      0.1703000    
 H    2.090000     -0.9344000      -1.758600    
 H    3.195500     -0.4217000       1.603900    
 H  -0.8805000       1.969200      -1.138500    
 H    3.340000       1.893600       1.457600    
 H    2.316000       4.027400      0.8433000    
 H   -2.070400      9.1899998E-02  -2.235400    
 H   -4.002400      -1.082400       2.183100    
 H   -4.513100      0.1590000      -1.890400    
 H   -5.478100     -0.4313000      0.3173000    
 H    3.102400      -2.875600      -1.980800    


%chk=000125820-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125820

0 1
Br -0.140083 4.923167 0.048798
Cl -1.326727 0.250281 2.470596
O 2.115135 -2.559737 -2.350165
O 3.204097 -2.773496 0.157914
N 2.591490 -0.600258 0.741398
N 0.362181 -1.522421 -1.066013
C 0.627179 0.735794 -0.038279
C -0.148973 -0.473971 -0.456108
C 1.934939 0.645769 0.535337
C -1.635108 -0.492062 -0.247222
C 1.798531 -1.515278 -1.425458
C 0.030414 2.019373 -0.174146
C 2.602408 -1.699208 -0.113185
C 2.585768 1.821134 0.991964
C 0.704467 3.168666 0.262458
C 1.980175 3.083578 0.863829
C -2.286942 -0.161340 0.967503
C -2.456842 -0.903035 -1.333905
C -3.688088 -0.199809 1.103384
C -3.860210 -0.946412 -1.220663
C -4.479305 -0.584776 -0.001776
H 2.088490 -0.563090 -1.915521
H 3.202415 -0.686171 1.560247
H -0.969821 2.096367 -0.609297
H 3.583201 1.745411 1.439378
H 2.494071 3.982557 1.214635
H -1.957058 -1.194897 -2.262775
H -4.148764 0.053341 2.062453
H -4.467278 -1.261160 -2.075383
H -5.569332 -0.611883 0.099041
H 2.328872 -3.380734 -1.827635


