%chk=000010454.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010454

0 1
 S    2.438100     -7.5000003E-02  5.5000000E-02
 S   -4.855000     -0.4975000     -0.1836000    
 O    3.032000       1.044800     -0.6554000    
 O    2.533300     -0.1669000       1.502100    
 N   -2.145400     -0.2266000      0.3100000    
 C   0.7336000     -0.1723000     -0.3935000    
 C  -4.8300002E-02   1.018700      0.1436000    
 C   -1.519700      0.9729000     -0.2487000    
 C    3.127200      -1.567200     -0.6238000    
 C   -3.295600     -0.3311000      9.4200000E-02
 H   0.6823000     -0.2101000      -1.486200    
 H   0.3498000      -1.113200      1.2700000E-02
 H   3.5700001E-02   1.051800       1.237000    
 H   0.3903000       1.951100     -0.2318000    
 H   -1.605700      0.9815000      -1.343600    
 H   -2.011800       1.877900      0.1326000    
 H    2.980300      -1.562500      -1.705300    
 H    4.193700      -1.586100     -0.3905000    
 H    2.628800      -2.424600     -0.1679000    


%chk=000010454-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000010454

0 1
S 2.415108 -0.133550 0.045532
S -4.030917 -1.976920 0.330940
O 3.281364 0.991643 -0.767146
O 2.360574 -0.141409 1.681005
N -2.368279 0.283657 -0.105233
C 0.578003 0.007635 -0.586715
C -0.067562 1.190702 0.135654
C -1.532581 1.420274 -0.325937
C 3.000671 -1.866675 -0.532337
C -3.077269 -0.673312 0.081088
H 0.685130 0.145883 -1.674803
H 0.109616 -0.958535 -0.338292
H -0.039596 1.018820 1.226484
H 0.498145 2.118034 -0.074414
H -1.552553 1.679107 -1.403674
H -1.943146 2.288734 0.225487
H 2.883745 -1.903623 -1.624483
H 4.056484 -1.915782 -0.231990
H 2.386666 -2.609083 -0.004266


