%chk=000050262.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050262

0 1
 Cl -0.7497000      -2.706500     -0.2600000    
 S   -2.507100      6.8700001E-02 -0.5615000    
 N    1.331500       1.213700      3.5900000E-02
 N    1.294400      -1.195700      5.2499998E-02
 N  -0.6465000       2.451900     -0.2873000    
 N    3.301100     -1.9200001E-02  0.3610000    
 C  -0.7448000      3.8600001E-02 -0.2816000    
 C  -1.1000000E-03   1.195800     -0.1749000    
 C  -3.6899999E-02  -1.139700     -0.1588000    
 C    1.906800      5.0000002E-04  0.1385000    
 C   -3.147600      9.2000000E-02   1.136100    
 H  -6.9100000E-02   3.278100     -0.1939000    
 H   -1.624300       2.514900     -3.2600001E-02
 H   -4.240100      0.1131000       1.108900    
 H   -2.792600      0.9799000       1.665700    
 H   -2.827200     -0.8028000       1.676300    
 H    3.778500     -0.9060000      0.4448000    
 H    3.805300      0.8537000      0.4325000    


%chk=000050262-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050262

0 1
Cl -0.947386 -2.660924 -0.096922
S -2.563456 0.263247 -0.526247
N 1.402510 1.281526 0.014928
N 1.277138 -1.157471 0.120915
N -0.518218 2.569144 -0.314548
N 3.313941 -0.030841 0.349101
C -0.764580 0.132672 -0.231666
C 0.047040 1.328144 -0.175637
C -0.045718 -1.067953 -0.072802
C 1.957478 0.041688 0.153382
C -3.222157 -0.095517 1.217870
H 0.084683 3.387465 -0.277968
H -1.522595 2.644526 -0.476387
H -4.316645 0.012635 1.158636
H -2.803440 0.626051 1.934612
H -2.955780 -1.126261 1.493260
H 3.748892 -0.943351 0.453947
H 3.858892 0.826219 0.377126


