%chk=000124044.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124044

0 1
 S   0.6658000       2.600600      0.5089000    
 S    2.836200      0.3678000     -0.6018000    
 S    1.708500     -0.5144000       2.039400    
 O   0.3376000       1.171400      -2.351200    
 O   -2.030000     -0.4611000      -2.789300    
 O   -2.370000      -2.586100      -1.093100    
 O   -3.645300      -1.369200       1.104500    
 C  -0.5465000      0.7756000      -1.300200    
 C   0.1355000      0.8867000      9.6500002E-02
 C   -1.131100     -0.6030000      -1.685200    
 C    1.294300     -0.1427000      0.2796000    
 C   -1.865000      -1.355000     -0.5597000    
 C   -3.030600     -0.6003000      7.8000002E-02
 C  -0.9642000       3.264100      0.9054000    
 C    3.645700      -1.243800     -0.7584000    
 C   0.3682000      -1.667900       2.429500    
 C  -0.8627000       4.724700       1.302100    
 C    4.977600      -1.104000      -1.470800    
 C   0.4758000      -2.143700       3.865800    
 H   -1.374900       1.493000      -1.334700    
 H  -0.6189000      0.6388000      0.8465000    
 H  -0.3285000      -1.251200      -2.059900    
 H    1.008200      -1.098000     -0.1653000    
 H   -1.160900      -1.650400      0.2149000    
 H   -2.722200      0.3534000      0.5108000    
 H   -3.802400     -0.4014000     -0.6736000    
 H  -0.1901000       1.291200      -3.158200    
 H   -1.517400     -0.1438000      -3.551400    
 H   -1.628200       3.182000      4.1200001E-02
 H   -1.399600       2.695000       1.732800    
 H   -2.816200      -3.056400     -0.3681000    
 H    2.997700      -1.918600      -1.326500    
 H    3.815200      -1.677600      0.2310000    
 H   0.4177000      -2.527700       1.755100    
 H  -0.5936000      -1.164500       2.304800    
 H  -0.2319000       4.858600       2.187500    
 H  -0.4561000       5.335500      0.4888000    
 H   -1.857000       5.115500       1.543200    
 H   -4.382000     -0.8405000       1.455600    
 H    4.853000     -0.7007000      -2.481500    
 H    5.663100     -0.4529000     -0.9177000    
 H    5.455800      -2.084900      -1.563300    
 H    1.417800      -2.673300       4.044300    
 H   0.4058000      -1.309700       4.572500    
 H  -0.3413000      -2.837200       4.091000    


%chk=000124044-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124044

0 1
S 0.858021 2.708161 0.458370
S 2.157918 -0.068101 -1.076562
S 1.627530 -0.171495 2.064766
O -0.230248 1.730595 -2.214578
O -2.160981 0.122561 -2.933721
O -2.074918 -1.240972 0.494194
O -4.195788 -2.549047 -0.433639
C -0.970062 1.171391 -1.072635
C -0.102053 1.060849 0.213758
C -1.544914 -0.156086 -1.628526
C 0.873189 -0.122096 0.313559
C -2.662166 -0.766056 -0.771741
C -3.339687 -1.946563 -1.482128
C -0.500117 3.692679 1.359712
C 3.206442 -1.570923 -0.587876
C 1.028874 -1.909444 2.575316
C -0.018552 5.133278 1.581201
C 4.438571 -1.643921 -1.501713
C 1.385532 -2.148106 4.049546
H -1.823593 1.846871 -0.835875
H -0.779331 0.975064 1.079923
H -0.714578 -0.881715 -1.752477
H 0.292734 -1.055714 0.230122
H -3.432839 0.005424 -0.560006
H -3.930297 -1.582735 -2.340274
H -2.578452 -2.675077 -1.828503
H 0.348898 2.463874 -1.859041
H -1.538807 0.753765 -3.389076
H -1.415727 3.665753 0.743897
H -0.688336 3.174570 2.315422
H -2.747318 -1.873826 0.869309
H 2.579527 -2.475665 -0.684932
H 3.486903 -1.428807 0.470564
H 1.518367 -2.650276 1.919194
H -0.060853 -1.941354 2.407912
H 0.911105 5.155996 2.177003
H 0.175078 5.643822 0.621157
H -0.787840 5.709980 2.127290
H -4.672507 -3.337325 -0.788708
H 4.151600 -1.753596 -2.562952
H 5.057191 -0.734303 -1.404424
H 5.062648 -2.514410 -1.226036
H 2.476521 -2.089655 4.214132
H 0.899958 -1.401310 4.702731
H 1.046258 -3.152158 4.366141


