%chk=000020780.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020780

0 1
 Cl  -3.131000      -2.733400      9.7900003E-02
 S   -2.348800       2.473000      3.1000001E-03
 N    1.421900     -0.8216000     -0.2200000    
 N  -0.3775000      0.6782000     -0.1131000    
 N  -0.7502000      -1.691800     -6.8499997E-02
 N   -2.612000     -0.1822000      4.2399999E-02
 C    2.398600      0.2648000     -0.2957000    
 C    3.803300     -0.2170000      0.1000000    
 C    2.406500      0.8212000      -1.718900    
 C    3.882800     -0.7678000       1.518100    
 C   6.6399999E-02 -0.6067000     -0.1318000    
 C   -1.710800      0.8109000     -2.5500000E-02
 C   -2.059500      -1.405800      1.6100001E-02
 C  -0.9895000       3.378200      0.7958000    
 H    2.119300       1.066500      0.4004000    
 H    4.139200     -0.9977000     -0.5943000    
 H    4.511500      0.6156000      8.5000005E-03
 H    1.432000       1.229900      -2.003900    
 H    2.661600      4.2700000E-02  -2.447000    
 H    3.141400       1.627600      -1.815000    
 H    1.742100      -1.780300     -0.2909000    
 H    3.553000     -1.9800000E-02   2.246100    
 H    3.263200      -1.661900       1.637300    
 H    4.915100      -1.042300       1.757700    
 H   -1.295800       4.415800      0.9532000    
 H  -0.1002000       3.373300      0.1597000    
 H  -0.7489000       2.935000       1.766000    


%chk=000020780-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020780

0 1
Cl -3.129277 -2.917076 -0.087512
S -2.483650 2.343463 0.705729
N 1.415458 -0.791096 -0.351144
N -0.384630 0.669382 0.124548
N -0.720266 -1.729806 -0.217910
N -2.611350 -0.299607 0.281979
C 2.439032 0.280219 -0.362360
C 3.789189 -0.295951 0.128029
C 2.548199 0.917333 -1.767917
C 3.767989 -0.771854 1.596078
C 0.084561 -0.598985 -0.145232
C -1.723458 0.749768 0.332089
C -2.021930 -1.482970 0.002380
C -0.972534 3.462363 0.684961
H 2.088935 1.051313 0.348259
H 4.093654 -1.128991 -0.540672
H 4.555701 0.492259 0.001659
H 1.568351 1.308194 -2.092383
H 2.894166 0.177243 -2.513199
H 3.268765 1.755397 -1.754740
H 1.689750 -1.750838 -0.577216
H 3.538765 0.066577 2.279585
H 3.002625 -1.552219 1.758819
H 4.746771 -1.190871 1.890874
H -1.357415 4.474353 0.885439
H -0.487214 3.415860 -0.299690
H -0.266489 3.150938 1.467250


