%chk=000005453.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005453

0 1
 S  -0.3484000      0.9498000       2.109400    
 P  -6.1500002E-02  5.2600000E-02  0.3907000    
 N   -1.357800      0.1092000     -0.6574000    
 N   0.2829000      -1.576000      0.4968000    
 N    1.200200      0.6587000     -0.5169000    
 C   -2.549400     -0.6123000     -0.2417000    
 C   -2.505400      0.8877000     -0.2208000    
 C   0.6365000      -2.238300     -0.7481000    
 C    1.672700      -1.954600      0.2999000    
 C    1.037600       2.014800      -1.014200    
 C    1.992600       1.708400      0.1022000    
 H   -2.532300      -1.138400      0.7027000    
 H   -3.107500      -1.092400      -1.034000    
 H   -3.030000       1.413200      -1.010600    
 H   -2.583900       1.371200      0.7382000    
 H   0.6556000      -1.666600      -1.665200    
 H   0.2870000      -3.257300     -0.8504000    
 H    2.012100      -2.788700      0.9036000    
 H    2.445900      -1.230700      9.8800004E-02
 H   0.1290000       2.550000     -0.7762000    
 H    1.449600       2.207200      -1.995500    
 H    3.049700       1.686700     -0.1376000    
 H    1.782700       2.142600       1.064900    


%chk=000005453-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005453

0 1
S -0.286529 0.782331 2.289577
P -0.093836 -0.011377 0.368689
N -1.533028 -0.008308 -0.701281
N 0.283664 -1.745069 0.326859
N 1.110572 0.789622 -0.717271
C -2.825178 -0.535942 -0.095917
C -2.661803 0.948010 -0.350520
C 1.018126 -2.341253 -0.860854
C 1.709056 -2.219471 0.488548
C 0.960621 2.280433 -0.974570
C 2.084600 1.774329 -0.095161
H -2.799008 -0.870543 0.948543
H -3.407131 -1.156183 -0.783376
H -3.131018 1.412572 -1.222375
H -2.525818 1.587797 0.532357
H 1.331798 -1.653570 -1.653674
H 0.613566 -3.305456 -1.183191
H 1.817380 -3.095690 1.134091
H 2.505157 -1.470592 0.579779
H 0.140212 2.810339 -0.473828
H 1.152045 2.573128 -2.011095
H 3.101469 1.700394 -0.492315
H 1.992983 1.951302 0.985585


