%chk=000060988.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060988

0 1
 S    3.044200      0.3064000      5.5399999E-02
 S   -3.236800      4.7100000E-02  6.2199999E-02
 O    3.497500     -0.1865000      -1.434700    
 O   -3.669600      5.5000000E-02  -1.514400    
 O    3.406900       1.709900      0.1700000    
 O    3.522100     -0.6683000       1.021500    
 O   -3.641700      -1.240700      0.6071000    
 O   -3.702500       1.286600      0.6645000    
 N    1.366900      -2.239500      2.1800000E-02
 C    1.296200      0.2032000      5.6400001E-02
 C   -1.491800      0.1068000      5.9099998E-02
 C   0.6410000      -1.028000      4.0199999E-02
 C  -0.7531000      -1.076300      4.1600000E-02
 C   0.5574000       1.386300      7.3899999E-02
 C  -0.8366000       1.338000      7.5300001E-02
 H   -1.255600      -2.040200      2.1700000E-02
 H    1.035100       2.361400      8.2599998E-02
 H   -1.390800       2.272400      8.0700003E-02
 H   0.8697000      -3.120400      8.6000003E-03
 H    2.376800      -2.242000      4.8000002E-03
 H    3.166700      0.3655000      -2.181800    
 H   -3.349300     -0.7124000      -2.044500    


%chk=000060988-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060988

0 1
S 3.112606 0.387485 -0.004761
S -3.325461 -0.088821 0.056225
O 3.274479 0.288897 -1.849312
O -3.499530 -0.101578 -1.789963
O 3.550908 1.864909 0.475464
O 3.849778 -0.921339 0.627898
O -3.774388 -1.529733 0.637772
O -3.976520 1.275589 0.628096
N 1.418714 -2.286005 0.241749
C 1.265802 0.179869 0.050940
C -1.449167 0.036270 0.040834
C 0.688003 -1.128213 0.137931
C -0.746120 -1.161007 0.125268
C 0.525215 1.374398 -0.019421
C -0.880474 1.322148 -0.021259
H -1.279609 -2.114927 0.200275
H 1.052696 2.332738 -0.065029
H -1.498409 2.221733 -0.060204
H 0.945255 -3.185043 0.285299
H 2.438711 -2.238614 0.359899
H 4.237981 0.439116 -2.080692
H -4.477771 -0.083573 -2.005008


