%chk=000066999.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066999

0 1
 S   0.4915000      0.1212000      0.5249000    
 S  -0.8750000      0.8339000     -0.8367000    
 P   -2.653100      0.4093000      0.2045000    
 O   0.2310000      -1.350500      0.4024000    
 O   -2.847800      -1.193900      0.3940000    
 O   -3.920800      0.8148000     -0.7310000    
 O   -2.674900       1.132900       1.526600    
 C    4.549100     -4.8300002E-02 -0.3827000    
 C    3.190300     -0.3174000      0.2894000    
 C    2.043500      0.4691000     -0.3365000    
 C    4.865900       1.448400     -0.3336000    
 C    5.686800     -0.8381000      0.2661000    
 C   -2.855600      -2.047700     -0.7373000    
 C   -5.231000      0.5663000     -0.2502000    
 H    4.487100     -0.3522000      -1.435300    
 H    2.977300      -1.392700      0.2294000    
 H    3.259700     -7.9599999E-02   1.359500    
 H    2.197500       1.548600     -0.2621000    
 H    1.939300      0.1984000      -1.392300    
 H    4.198800       2.026200     -0.9802000    
 H    4.791000       1.841800      0.6858000    
 H    5.884700       1.638300     -0.6902000    
 H    6.634300     -0.6577000     -0.2523000    
 H    5.814700     -0.5580000       1.317200    
 H    5.481700      -1.912900      0.2249000    
 H   -1.848600      -2.136400      -1.150500    
 H   -3.536200      -1.670200      -1.504300    
 H   -3.194700      -3.037700     -0.4225000    
 H   -5.948900      0.9671000     -0.9699000    
 H   -5.377000       1.064000      0.7120000    
 H   -5.399400     -0.5078000     -0.1421000    


%chk=000066999-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066999

0 1
S 0.492348 -0.599758 0.566745
S -1.057299 0.658955 -0.927642
P -2.919178 0.264839 0.362562
O 0.658539 -2.140168 0.007172
O -2.914511 -1.427094 0.706225
O -4.084075 0.463183 -0.918002
O -3.174949 1.122769 1.672032
C 4.591273 0.130749 -0.435806
C 3.312015 -0.405285 0.273253
C 2.038861 0.305426 -0.197029
C 4.843705 1.629135 -0.143457
C 5.809908 -0.723130 -0.011952
C -2.751620 -2.414541 -0.395736
C -5.361981 1.146238 -0.589770
H 4.446411 0.007132 -1.530196
H 3.213315 -1.487401 0.058280
H 3.434405 -0.292883 1.369647
H 1.935790 1.346597 0.147577
H 1.897539 0.241321 -1.289047
H 4.024041 2.272752 -0.512213
H 4.951212 1.802010 0.944987
H 5.775596 1.969193 -0.630868
H 6.724799 -0.390845 -0.535867
H 5.992915 -0.632283 1.075949
H 5.653944 -1.793068 -0.242628
H -1.689009 -2.482385 -0.685159
H -3.385269 -2.147282 -1.258939
H -3.083204 -3.365089 0.048354
H -5.865566 1.257415 -1.561333
H -5.176170 2.133455 -0.132891
H -5.972583 0.529241 0.092751


