%chk=000008337.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008337

0 1
 S  -0.9049000       1.854700       1.217300    
 S   0.9049000      -1.854700       1.217300    
 O  -0.3783000       3.070700      0.2627000    
 O   0.3783000      -3.070600      0.2627000    
 O   -2.014100       2.374100       2.000100    
 O   0.2475000       1.251200       1.863700    
 O    2.014100      -2.374000       2.000100    
 O  -0.2475000      -1.251100       1.863700    
 N   -4.875900     -0.6856000     -0.8103000    
 N    4.875900      0.6856000     -0.8103000    
 C  -0.7194000     -8.9400001E-02 -0.7285000    
 C   0.7194000      8.9400001E-02 -0.7285000    
 C   -1.547200      0.6557000      0.1115000    
 C    1.547200     -0.6557000      0.1115000    
 C   -1.272000      -1.031900      -1.595600    
 C    1.272100       1.031800      -1.595600    
 C   -2.927800      0.4581000      8.4399998E-02
 C    2.927800     -0.4580000      8.4399998E-02
 C   -3.480400     -0.4846000     -0.7827000    
 C    3.480400      0.4846000     -0.7827000    
 C   -2.652500      -1.229500      -1.622600    
 C    2.652500       1.229500      -1.622600    
 H  -0.6430000      -1.621600      -2.258500    
 H   0.6430000       1.621500      -2.258600    
 H   -3.592900       1.028100      0.7273000    
 H    3.592900      -1.028000      0.7273000    
 H   -3.071000      -1.967100      -2.302600    
 H    3.071100       1.967100      -2.302600    
 H   -5.276400      -1.369700      -1.438200    
 H   -5.477600     -0.1470000     -0.2013000    
 H    5.276500       1.368500      -1.439600    
 H    5.477700      0.1459000     -0.2027000    
 H   -1.068900       3.501200     -0.2942000    
 H    1.068800      -3.501200     -0.2941000    


%chk=000008337-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008337

0 1
S -1.147525 2.257669 1.003087
S 1.147553 -2.257658 1.003064
O -0.850870 3.409916 -0.450626
O 0.850553 -3.409844 -0.450625
O -2.428251 2.839324 1.807916
O 0.245003 2.052362 1.791599
O 2.428330 -2.839479 1.807696
O -0.244835 -2.052190 1.791778
N -4.983174 -0.715838 -0.830961
N 4.983219 0.715562 -0.831456
C -0.738095 -0.107240 -0.609433
C 0.738128 0.107210 -0.609485
C -1.684778 0.765224 -0.028025
C 1.684819 -0.765269 -0.028121
C -1.309988 -1.220611 -1.290529
C 1.310015 1.220497 -1.290723
C -3.074615 0.608987 -0.073536
C 3.074661 -0.609120 -0.073779
C -3.610111 -0.516065 -0.760893
C 3.610151 0.515865 -0.761248
C -2.695409 -1.424429 -1.370362
C 2.695440 1.424238 -1.370694
H -0.630964 -1.940574 -1.756779
H 0.630987 1.940447 -1.756985
H -3.720796 1.328429 0.440853
H 3.720850 -1.328570 0.440588
H -3.079735 -2.300800 -1.905274
H 3.079763 2.300546 -1.905709
H -5.365815 -1.535621 -1.292969
H -5.628865 -0.076430 -0.376553
H 5.365861 1.535287 -1.293567
H 5.628919 0.076137 -0.377087
H -0.676653 4.316941 -0.064482
H 0.676524 -4.316903 -0.064479


