%chk=000171602.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171602

0 1
 S    4.054100      0.8839000     -9.6299998E-02
 O    3.654100     -0.6609000      0.2499000    
 O    5.572900       1.025500      0.4819000    
 O    4.123600       1.001500      -1.541000    
 O    3.201000       1.775500      0.6674000    
 C   -1.234900      2.6300000E-02  0.3077000    
 C  -9.3099996E-02 -0.8539000     -0.2044000    
 C   -2.587900     -0.4555000     -0.2188000    
 C    1.265500     -0.3459000      0.2908000    
 C   -3.733400      0.4044000      0.3201000    
 C    2.425600      -1.196600     -0.2341000    
 C   -5.082200     -5.9000000E-02 -0.2347000    
 C   -6.261300      0.7844000      0.2553000    
 C    2.303100      -2.642100      0.2292000    
 C   -7.607100      0.3123000     -0.2730000    
 H   -1.070500       1.064400     -5.9000002E-03
 H   -1.240800      1.6899999E-02   1.404400    
 H  -0.2708000      -1.877100      0.1428000    
 H  -0.1020000     -0.8728000      -1.301000    
 H   -2.586400     -0.4228000      -1.315200    
 H   -2.746500      -1.500600      7.3500000E-02
 H    1.288200     -0.2976000       1.386500    
 H    1.342500      0.6802000     -7.5599998E-02
 H   -3.750100      0.3546000       1.415400    
 H   -3.567400       1.453200      4.5899998E-02
 H    2.448800      -1.178100      -1.330100    
 H   -5.248200      -1.105900      4.8400000E-02
 H   -5.053700     -2.8600000E-02  -1.331000    
 H   -6.287600      0.7687000       1.351400    
 H   -6.109600       1.828400     -4.3699998E-02
 H    2.187000      -2.699100       1.317100    
 H    3.218800      -3.193000     -1.4000000E-02
 H    1.466900      -3.162200     -0.2454000    
 H   -7.810100     -0.7166000      4.0500000E-02
 H   -8.410600      0.9501000      0.1082000    
 H   -7.631300      0.3494000      -1.366700    
 H    5.709200      0.6831000       1.396500    


%chk=000171602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171602

0 1
S 4.212945 1.110070 -0.029569
O 3.729325 -0.597345 0.512132
O 5.957039 0.764677 0.349343
O 3.958653 1.245168 -1.610663
O 3.737935 2.269494 0.963794
C -1.299964 0.030845 0.361269
C -0.109033 -0.832638 -0.113126
C -2.656809 -0.451649 -0.198651
C 1.238373 -0.362633 0.485009
C -3.851349 0.410016 0.269237
C 2.449877 -1.114230 -0.091973
C -5.210304 -0.081529 -0.278499
C -6.406456 0.779061 0.188735
C 2.510774 -2.609496 0.255825
C -7.760309 0.276252 -0.357794
H -1.131136 1.085205 0.059824
H -1.338188 0.026628 1.470429
H -0.298402 -1.889333 0.163189
H -0.055422 -0.798619 -1.221516
H -2.617500 -0.450980 -1.308113
H -2.825724 -1.505923 0.106016
H 1.231816 -0.481018 1.585883
H 1.353290 0.722047 0.282252
H -3.885553 0.417664 1.378891
H -3.689078 1.462657 -0.043506
H 2.509702 -0.969645 -1.190175
H -5.374071 -1.134008 0.035185
H -5.178204 -0.089962 -1.388272
H -6.435322 0.790425 1.297564
H -6.245204 1.829625 -0.128256
H 2.471628 -2.756614 1.348711
H 3.435013 -3.067846 -0.133948
H 1.648865 -3.126360 -0.201919
H -7.959112 -0.761528 -0.029298
H -8.598465 0.907363 -0.009237
H -7.768552 0.284271 -1.464230
H 6.024719 -0.235612 0.387454


