%chk=000035724.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035724

0 1
 S    2.951600       2.334600      -1.314000    
 S  -0.9349000       1.733700       2.179000    
 O    2.654900       3.349300     -6.8200000E-02
 O  -0.9415000       3.310600       1.751400    
 O    4.385200       2.364400      -1.556700    
 O    2.009400       2.635700      -2.378900    
 O   -1.725300       1.617600       3.394400    
 O   0.4374000       1.257000       2.134500    
 C   9.8800004E-02   1.341100     -0.6987000    
 C    1.221600      0.3839000     -0.4624000    
 C   -1.267000      0.7755000     -0.3703000    
 C    2.542800      0.7428000     -0.7122000    
 C   -1.797800      0.9108000      0.8978000    
 C   0.9229000     -0.8909000      1.9300001E-02
 C   -1.958700      0.1242000      -1.379000    
 C    1.944700      -1.824600      0.2572000    
 C   -3.229200     -0.4163000      -1.122000    
 C    3.288200      -1.459700      3.1000001E-03
 C   -3.787300     -0.2866000      0.1721000    
 C    3.570400     -0.1721000     -0.4812000    
 C   -3.058900      0.3801000       1.170600    
 C    1.662500      -3.112400      0.7415000    
 C   -3.957700      -1.083000      -2.120500    
 C    4.310200      -2.393200      0.2414000    
 C   -5.058000     -0.8268000      0.4292000    
 C    2.690400      -4.027200      0.9720000    
 C   -5.218600      -1.614000      -1.847100    
 C    4.011600      -3.668300      0.7226000    
 C   -5.767700      -1.486000     -0.5748000    
 H   0.2581000       2.301500     -0.2039000    
 H   6.0600001E-02   1.572900      -1.769800    
 H  -8.8000000E-02  -1.224100      0.2306000    
 H   -1.521800      2.5200000E-02  -2.370800    
 H    4.607000      9.7800002E-02 -0.6698000    
 H   -3.499400      0.4761000       2.160500    
 H   0.6374000      -3.415800      0.9442000    
 H   -3.548300      -1.195000      -3.122300    
 H    5.350300      -2.134900      5.3599998E-02
 H   -5.507200     -0.7388000       1.416300    
 H    2.458700      -5.020000       1.346600    
 H   -5.771700      -2.127500      -2.628200    
 H    4.811300      -4.380900      0.9025000    
 H   -6.749400      -1.899500     -0.3627000    
 H    3.182300       3.182500      0.7482000    
 H   -1.833500       3.723400       1.671300    


%chk=000035724-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000035724

0 1
S 2.824906 2.571867 -0.022202
S -0.993439 2.427759 1.557315
O 2.880726 2.748130 1.769622
O -0.764490 3.839234 0.474425
O 4.315070 2.884069 -0.529667
O 1.602560 3.509389 -0.597432
O -1.945680 2.882985 2.769238
O 0.483916 1.796955 1.894791
C 0.031855 0.979332 -1.245978
C 1.201385 0.163564 -0.671043
C -1.348310 0.626104 -0.701704
C 2.455156 0.706665 -0.236458
C -1.925319 1.175549 0.491481
C 1.117624 -1.236318 -0.650590
C -2.173734 -0.261365 -1.407501
C 2.197450 -2.083461 -0.249957
C -3.488550 -0.626986 -0.970252
C 3.453472 -1.483800 0.144374
C -4.010155 -0.052357 0.251377
C 3.551774 -0.059684 0.148861
C -3.191561 0.872574 0.972293
C 2.081099 -3.512705 -0.239007
C -4.309150 -1.540144 -1.709606
C 4.550143 -2.321940 0.532375
C -5.324832 -0.408081 0.696811
C 3.163117 -4.308180 0.143428
C -5.587573 -1.871976 -1.254326
C 4.406462 -3.710124 0.531047
C -6.099189 -1.303846 -0.043351
H 0.231216 2.056312 -1.149362
H 0.012480 0.784733 -2.335718
H 0.176203 -1.704780 -0.960977
H -1.799754 -0.685320 -2.348139
H 4.483898 0.423207 0.462480
H -3.559099 1.348969 1.888446
H 1.131508 -3.973673 -0.534468
H -3.922475 -1.974914 -2.638588
H 5.497350 -1.858768 0.830679
H -5.712645 0.032693 1.621957
H 3.067247 -5.399170 0.150316
H -6.209013 -2.570473 -1.824638
H 5.243402 -4.350455 0.828440
H -7.103768 -1.574754 0.297555
H 1.934891 2.463217 2.084527
H 0.220228 3.823065 0.125528


