%chk=000028799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028799

0 1
 Cl  -1.956400      -2.817100     -0.9414000    
 Cl  -4.900800      -2.539800      0.3715000    
 N   -1.374200       2.194800     -0.1613000    
 N   0.8077000       1.284000     -2.1900000E-02
 N   0.3898000       3.609700     -0.3465000    
 C    3.059900      0.3025000      4.8200000E-02
 C    2.251000       1.551800     -5.0600000E-02
 C   -2.202800       1.058400     -4.1400000E-02
 C    3.443800     -0.1824000       1.298400    
 C    3.432500     -0.3808000      -1.109300    
 C   1.1000000E-02   2.292900     -0.1600000    
 C   -1.751700     -0.1829000     -0.4885000    
 C   -3.471300       1.178800      0.5244000    
 C    4.200300      -1.350700       1.391100    
 C    4.189000      -1.549000      -1.016600    
 C   -2.570500      -1.305700     -0.3694000    
 C   -4.290200      5.5900000E-02  0.6434000    
 C    4.572900      -2.034000      0.2336000    
 C   -3.839900      -1.186300      0.1964000    
 H    2.525100       2.220700      0.7761000    
 H    2.523900       2.071300     -0.9791000    
 H   -1.889300       3.069900     -0.1067000    
 H    3.158200      0.3392000       2.208000    
 H    3.137700     -1.4900000E-02  -2.089300    
 H  -0.7838000     -0.2932000     -0.9681000    
 H   -3.833800       2.140800      0.8776000    
 H    4.498700      -1.728800       2.364600    
 H    4.478400      -2.081500      -1.917800    
 H   -5.276400      0.1670000       1.087100    
 H    5.161600      -2.943900      0.3057000    
 H  -0.3019000       4.342800     -0.4593000    
 H    1.361600       3.896100     -0.3765000    


%chk=000028799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028799

0 1
Cl -1.718465 -2.969890 0.137457
Cl -4.946187 -2.615784 -0.451786
N -1.385085 2.269186 0.024869
N 0.795635 1.378942 0.383880
N 0.420183 3.742742 -0.015023
C 3.024066 0.266742 0.282359
C 2.254519 1.580647 0.415814
C -2.166541 1.095762 -0.069581
C 4.370721 0.199227 0.720343
C 2.439615 -0.877731 -0.309043
C 0.014921 2.401315 0.140039
C -1.622711 -0.207196 0.078824
C -3.561388 1.243913 -0.315259
C 5.121680 -0.987227 0.567029
C 3.187437 -2.067617 -0.461879
C -2.465349 -1.325706 -0.045860
C -4.390346 0.112762 -0.421120
C 4.530996 -2.127599 -0.026229
C -3.845621 -1.183074 -0.293756
H 2.558379 2.061635 1.372922
H 2.597795 2.263498 -0.402061
H -1.911651 3.140497 0.099625
H 4.834976 1.076944 1.189971
H 1.398879 -0.828967 -0.641698
H -0.559617 -0.303819 0.309431
H -4.000064 2.242248 -0.432223
H 6.160551 -1.024853 0.914542
H 2.718980 -2.947356 -0.917664
H -5.461258 0.227911 -0.611505
H 5.109187 -3.051312 -0.141960
H -0.119495 4.400513 -0.574347
H 1.375358 3.999247 0.216293


