%chk=000177826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177826

0 1
 S    5.659400       1.474600     -9.9999998E-03
 O   -4.067300       1.955700      0.8997000    
 O   -5.170200     -2.6900001E-02  0.6788000    
 O   0.2081000      -2.430500      0.5080000    
 C   -1.700400      0.2250000      0.3204000    
 C   -3.056400      0.3170000     -0.4573000    
 C  -0.8555000     -0.6463000     -0.6470000    
 C   -3.241200      -1.114600     -0.9931000    
 C   -1.834200      -1.658800      -1.250400    
 C   -1.026200       1.585800      0.5581000    
 C   -1.872200     -0.4638000       1.699500    
 C   -3.060300       1.318200      -1.625300    
 C   -4.217900      0.6955000      0.4240000    
 C   0.3213000      -1.321700     -9.4999997E-03
 C    1.641400     -0.6301000     -9.7000003E-03
 C    1.939500      0.2259000      -1.046500    
 C    2.515000     -0.8723000       1.027100    
 C    3.175100      0.8730000      -1.046600    
 C    3.750500     -0.2250000       1.026900    
 C    4.080700      0.6476000     -9.8999999E-03
 C    6.810900      7.1800001E-02 -3.7099998E-02
 H  -0.5423000     -2.9400000E-02  -1.489600    
 H   -3.850700      -1.148300      -1.903500    
 H   -3.738000      -1.767900     -0.2652000    
 H   -1.749600      -2.669300     -0.8372000    
 H   -1.655400      -1.753100      -2.328500    
 H  -0.7790000       2.093900     -0.3796000    
 H   -1.651400       2.257900       1.151800    
 H  -8.7200001E-02   1.467600       1.110000    
 H   -2.519400      0.1223000       2.360900    
 H   -2.304800      -1.465600       1.614000    
 H  -0.9132000     -0.5616000       2.220900    
 H   -2.892300       2.349700      -1.298200    
 H   -2.299100       1.081500      -2.375500    
 H   -4.029800       1.309300      -2.139400    
 H   -4.814400       2.221100       1.477200    
 H    1.296000      0.4046000      -1.897900    
 H    2.267200      -1.543800       1.843600    
 H    3.419400       1.542400      -1.867900    
 H    4.436700     -0.4096000       1.849600    
 H    7.832400      0.4494000     -0.1335000    
 H    6.597100     -0.5793000     -0.8891000    
 H    6.740900     -0.5051000      0.8886000    


%chk=000177826-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177826

0 1
S 5.904488 1.264780 -0.615911
O -4.233237 2.107262 0.817882
O -5.199137 0.013992 0.938697
O 0.220299 -2.374258 0.674420
C -1.759390 0.257086 0.327500
C -3.156352 0.326015 -0.461263
C -0.935539 -0.692022 -0.647122
C -3.369726 -1.135856 -0.964362
C -1.954307 -1.769458 -1.111690
C -1.082709 1.631064 0.530346
C -1.965037 -0.408950 1.715143
C -3.118192 1.313045 -1.662806
C -4.291347 0.740583 0.476677
C 0.316904 -1.303770 -0.005357
C 1.658439 -0.648379 -0.163050
C 1.896409 0.504320 -0.964056
C 2.766230 -1.225001 0.518783
C 3.185084 1.054154 -1.079398
C 4.057855 -0.681461 0.414106
C 4.279569 0.466013 -0.390719
C 7.043287 0.196831 0.426100
H -0.631968 -0.076192 -1.513301
H -3.924809 -1.133654 -1.919292
H -3.983989 -1.697448 -0.241311
H -1.848453 -2.661824 -0.472130
H -1.743291 -2.082832 -2.149515
H -0.824064 2.119883 -0.425926
H -1.750387 2.311536 1.087023
H -0.148201 1.515437 1.108600
H -2.585965 0.237083 2.362797
H -2.450632 -1.396515 1.644555
H -0.996956 -0.555348 2.223646
H -2.947605 2.351423 -1.338979
H -2.326013 1.022118 -2.375177
H -4.079537 1.280588 -2.207268
H -4.991194 2.308983 1.432115
H 1.077215 0.982968 -1.508433
H 2.581733 -2.114351 1.130672
H 3.345915 1.939398 -1.704671
H 4.881730 -1.155187 0.956367
H 8.041815 0.646159 0.314072
H 7.060613 -0.837211 0.048843
H 6.743652 0.225799 1.484995


