%chk=000004656.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004656

0 1
 I   -5.065600     -2.4999999E-03  0.9115000    
 Cl -0.2975000      -2.728400     -0.5695000    
 Cl -0.3011000       2.730000     -0.5686000    
 N    3.255000     -5.0000002E-04 -0.7803000    
 N   0.9358000      1.6000000E-03 -0.9517000    
 N    2.069000      1.7000000E-03   1.154500    
 C    4.314600     -3.5999999E-03  0.1816000    
 C    3.523800      1.4000000E-03   1.496100    
 C    2.043200      1.5000000E-03 -0.1570000    
 C  -0.4006000      6.0000003E-04 -0.5374000    
 C   -1.082000      -1.207700     -0.3255000    
 C   -1.083700       1.208300     -0.3255000    
 C   -2.414000      -1.208700      8.8200003E-02
 C   -2.415900       1.207400      8.8299997E-02
 C   -3.081100     -1.2000001E-03  0.2953000    
 H    4.944100      0.8859000      8.7899998E-02
 H    4.936000     -0.8991000      9.0099998E-02
 H    3.756700     -0.8840000       2.097000    
 H    3.758100      0.8905000       2.091100    
 H    3.405100     -2.7000001E-03  -1.781500    
 H    1.060900      3.8999999E-03  -1.959300    
 H   -2.929000      -2.153700      0.2483000    
 H   -2.932100       2.151700      0.2486000    


%chk=000004656-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004656

0 1
I -5.008989 -0.002036 1.233245
Cl -0.259735 -2.784969 -0.708946
Cl -0.266014 2.787151 -0.715767
N 3.336268 0.001559 -0.839801
N 0.943762 0.001952 -1.163691
N 1.952877 -0.001304 1.012784
C 4.320506 -0.002883 0.263483
C 3.362701 -0.001685 1.525097
C 2.041741 0.000683 -0.300662
C -0.382310 0.001064 -0.646908
C -1.077801 -1.205213 -0.372217
C -1.080609 1.206381 -0.375195
C -2.384087 -1.232393 0.155300
C -2.387021 1.231883 0.152092
C -3.021618 -0.000670 0.414599
H 4.970767 0.893069 0.234651
H 4.965070 -0.902963 0.232352
H 3.530209 -0.894025 2.156036
H 3.530831 0.891553 2.154691
H 3.583844 0.000580 -1.825626
H 1.087994 0.005826 -2.171644
H -2.876757 -2.185861 0.356970
H -2.881929 2.184702 0.351357


