%chk=000155869.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155869

0 1
 S    1.707300      0.9767000     -5.6200001E-02
 S   -1.716300      0.9693000     -1.5100000E-02
 P   1.1000000E-03 -0.2416000      4.2399999E-02
 O  -1.3300000E-02  -1.211600      -1.262200    
 O   1.7200001E-02  -1.045600       1.317400    
 C    4.465700      0.5307000     -7.8100003E-02
 C   -4.464900      0.5364000      2.5599999E-02
 C    3.111500     -0.1755000     -1.4700000E-02
 C   -3.110900     -0.1723000      5.7100002E-02
 C    5.661100     -0.4226000      2.7000001E-03
 C   -5.660300     -0.4202000      3.9500002E-02
 C    6.976000      0.3415000      3.7200000E-02
 C   -6.974100      0.3349000     -9.5500000E-02
 H    4.534700       1.108400      -1.008800    
 H    4.534000       1.250100      0.7484000    
 H   -4.544200       1.215100      0.8846000    
 H   -4.524000       1.158000     -0.8775000    
 H    3.011800     -0.8676000     -0.8573000    
 H    3.039600     -0.7629000      0.9066000    
 H   -3.024500     -0.7669000      0.9725000    
 H   -3.032900     -0.8607000     -0.7907000    
 H    5.581800      -1.041100      0.9041000    
 H    5.653100      -1.100000     -0.8588000    
 H   -5.571900      -1.136300     -0.7856000    
 H   -5.662700     -0.9963000      0.9718000    
 H    7.817700     -0.3562000      9.0700001E-02
 H    7.025100       1.000100      0.9102000    
 H    7.097900      0.9529000     -0.8626000    
 H   -7.815900     -0.3645000     -7.9400003E-02
 H   -7.012800      0.8910000      -1.037600    
 H   -7.105300       1.043700      0.7283000    
 H  -0.7683000      -1.825800      -1.384300    


%chk=000155869-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155869

0 1
S 0.898743 0.498425 -1.153004
S -2.135903 -0.557373 -2.811358
P -0.360233 -1.331044 -1.587880
O 0.692200 -2.100231 -2.751560
O -0.788307 -2.282002 -0.374275
C 3.402721 0.683671 0.108147
C -3.528738 0.260726 -0.421810
C 2.428088 -0.386088 -0.412253
C -3.447354 -0.869276 -1.456357
C 4.678102 0.035748 0.705532
C -4.646284 -0.002631 0.617605
C 5.669453 1.090774 1.242904
C -4.739829 1.122909 1.670703
H 3.690996 1.365356 -0.716055
H 2.905967 1.300992 0.881800
H -2.557475 0.353963 0.102288
H -3.713667 1.226186 -0.931655
H 2.870833 -0.992820 -1.217809
H 2.072128 -1.040303 0.400878
H -3.192628 -1.834945 -0.986192
H -4.385832 -0.979638 -2.028795
H 4.389883 -0.655768 1.522402
H 5.174474 -0.580561 -0.070452
H -5.620193 -0.104520 0.096542
H -4.455331 -0.969731 1.124350
H 6.572051 0.612902 1.665142
H 5.205553 1.701992 2.039383
H 5.994426 1.776277 0.438079
H -5.539795 0.919357 2.405785
H -4.957521 2.096884 1.193610
H -3.788396 1.225238 2.225117
H 0.445171 -3.043372 -2.946110


