%chk=000045454.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045454

0 1
 S   -3.910700     -0.5109000      0.5075000    
 S    3.886800      0.5834000      0.4807000    
 O   4.1999999E-03  1.0500000E-02  0.8765000    
 N   -1.748100      0.6125000     -0.8027000    
 N    1.760700     -0.6735000     -0.7664000    
 C  -0.6175000       1.011300      5.7200000E-02
 C   0.6275000      -1.029600      0.1090000    
 C   -2.660100      0.1370000     -0.2355000    
 C    2.657100     -0.1406000     -0.2261000    
 H   0.1477000       1.472800     -0.5780000    
 H  -0.9479000       1.807800      0.7372000    
 H  -0.1365000      -1.521800     -0.5042000    
 H   0.9574000      -1.791100      0.8280000    


%chk=000045454-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045454

0 1
S -4.299786 -0.549503 -0.917647
S 4.300458 0.508953 -0.940820
O 0.002503 0.022551 1.241749
N -1.758485 0.569173 -0.325796
N 1.763178 -0.592128 -0.300773
C -0.639171 1.059431 0.422073
C 0.643180 -1.048857 0.467007
C -2.857362 0.090830 -0.530868
C 2.859352 -0.116818 -0.526174
H 0.092331 1.501290 -0.280716
H -0.963245 1.815797 1.157583
H -0.088848 -1.519311 -0.216402
H 0.966497 -1.773607 1.233984


