%chk=000023685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023685

0 1
 Cl  -4.389500       2.149300      0.3015000    
 S    1.141500      0.1001000      -1.016400    
 N    3.716000      0.8680000     -0.8536000    
 N    3.055400     -0.6863000      0.6753000    
 C    4.935600      0.6718000     -0.1289000    
 C    4.501900     -0.3779000      0.9087000    
 C    2.740800      7.7200003E-02 -0.3367000    
 C   0.1931000     -0.3010000      0.4829000    
 C   -1.275600     -0.3611000      0.2310000    
 C   -2.054300      0.7879000      0.3690000    
 C   -1.870600      -1.566000     -0.1435000    
 C   -3.427800      0.7322000      0.1325000    
 C   -3.244000      -1.621800     -0.3799000    
 C   -4.022700     -0.4727000     -0.2420000    
 H    5.269800       1.595900      0.3515000    
 H    5.730300      0.2906000     -0.7766000    
 H    5.090400      -1.295800      0.8062000    
 H    4.632600      1.8000000E-03   1.927600    
 H    3.615700       1.507100      -1.632200    
 H   0.4104000      0.4465000       1.255400    
 H   0.5274000      -1.266000      0.8817000    
 H   -1.589400       1.727300      0.6598000    
 H   -1.275400      -2.468400     -0.2559000    
 H   -3.707000      -2.559800     -0.6718000    
 H   -5.091700     -0.5312000     -0.4298000    


%chk=000023685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023685

0 1
Cl -5.066313 0.936659 -0.406385
S 1.185602 1.939972 -0.095720
N 3.592125 0.833979 -0.874118
N 2.433920 -0.447616 0.651799
C 4.552162 -0.268445 -0.628996
C 3.714815 -1.183122 0.349063
C 2.470962 0.653170 -0.067579
C -0.000201 1.201180 1.224043
C -1.120215 0.382477 0.631548
C -2.395605 0.965649 0.412675
C -0.912073 -0.983696 0.303303
C -3.424943 0.176281 -0.130968
C -1.963792 -1.751078 -0.240911
C -3.238632 -1.177748 -0.465761
H 5.481940 0.104687 -0.156877
H 4.819291 -0.789175 -1.566498
H 3.470908 -2.155328 -0.116569
H 4.255305 -1.384501 1.290528
H 3.813543 1.684962 -1.385906
H -0.361577 2.084946 1.772642
H 0.663921 0.593732 1.859996
H -2.578575 2.016070 0.662281
H 0.081222 -1.414476 0.472210
H -1.801373 -2.804886 -0.492190
H -4.059515 -1.765993 -0.885811


