%chk=000014303.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014303

0 1
 S    3.513100     -0.5194000      0.3789000    
 S    2.983700       1.333000     -0.2925000    
 O   -3.066000      -1.113400     -8.0700003E-02
 N  -0.3475000     -0.7016000     -6.8499997E-02
 N   -1.235900      0.3102000      3.0200001E-02
 N   -3.368400       1.153800      0.1254000    
 C   0.8845000     -0.3085000     -4.4399999E-02
 C    1.994200      -1.329200     -0.1429000    
 C    1.231600       1.158500      7.8299999E-02
 C   -2.589400      1.6600000E-02  1.6200000E-02
 H    1.777400      -2.186300      0.5004000    
 H    2.079700      -1.670800      -1.178700    
 H   0.7049000       1.768300     -0.6601000    
 H    1.029800       1.516100       1.092300    
 H  -0.9478000       1.264200      0.1951000    
 H   -4.381400       1.098300      0.1298000    
 H   -2.955400       2.077100      0.2028000    


%chk=000014303-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014303

0 1
S 3.392301 -0.844964 0.931702
S 3.329554 1.238997 -0.063467
O -3.077269 -1.195076 0.074672
N -0.342984 -0.584006 -0.045257
N -1.317237 0.391927 0.026938
N -3.543733 1.085447 0.236640
C 0.917829 -0.225951 -0.124688
C 1.951211 -1.328241 -0.207774
C 1.435257 1.214522 -0.071905
C -2.682704 -0.005888 0.113092
H 1.533005 -2.284550 0.140290
H 2.367438 -1.432669 -1.223685
H 1.129523 1.799585 -0.960918
H 1.075756 1.720443 0.844474
H -1.082241 1.391974 -0.022315
H -4.537340 0.874265 0.285596
H -3.241267 2.051087 0.348204


