%chk=000059264.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059264

0 1
 S  -0.5305000       1.670200      0.6863000    
 O    4.603100       2.186000     -0.2614000    
 C    2.251600       1.827100      0.2521000    
 C    3.480500       1.359500     -0.5950000    
 C   0.9785000       1.017700     -9.9699996E-02
 C   -4.184600     -0.1216000     -0.1401000    
 C   -3.131600      0.8289000      0.4408000    
 C   -5.601600      0.1584000      0.3652000    
 C   -1.717600      0.5230000     -4.7100000E-02
 C    2.527200       1.801400       1.765200    
 C   -6.620300     -0.7701000     -0.3002000    
 C    3.250700       1.525700      -2.102700    
 C   -8.041400     -0.4669000      0.1742000    
 C    3.847800     -4.1200001E-02 -0.3086000    
 C   -9.060300      -1.365300     -0.5086000    
 C    4.147800      -1.180500     -7.3399998E-02
 C    4.505500      -2.533600      0.2025000    
 C    4.110000      -3.602100     -0.7733000    
 C    5.185100      -2.816700       1.323800    
 H    2.075300       2.881500     -7.0000002E-03
 H    1.094300     -2.7799999E-02  0.2047000    
 H   0.7981000       1.042700      -1.177100    
 H   -4.167000     -4.2599998E-02  -1.234300    
 H   -3.912100      -1.155200      0.1070000    
 H   -3.168200      0.7619000       1.535900    
 H   -3.403100       1.858200      0.1729000    
 H   -5.636100      2.9500000E-02   1.453600    
 H   -5.863700       1.202200      0.1540000    
 H   -1.443100     -0.5006000      0.2283000    
 H   -1.675500      0.6100000      -1.137800    
 H    2.600100      0.7760000       2.142400    
 H    1.739500       2.310800       2.328700    
 H    3.463300       2.315900       2.005500    
 H   -6.370400      -1.813700     -7.3799998E-02
 H   -6.565900     -0.6536000      -1.389500    
 H    2.504500      0.8295000      -2.498300    
 H    4.178800       1.353900      -2.662600    
 H    2.936300       2.549000      -2.336800    
 H   -8.108600     -0.6046000       1.259600    
 H   -8.289300      0.5801000     -3.6200002E-02
 H    5.362200       1.907700     -0.8021000    
 H   -8.859600      -2.419800     -0.2939000    
 H   -9.041500      -1.225700      -1.594200    
 H   -10.06910      -1.132300     -0.1537000    
 H    3.020900      -3.632600     -0.8852000    
 H    4.439400      -4.596400     -0.4531000    
 H    4.553000      -3.405100      -1.755500    
 H    5.473500      -3.834800       1.565100    
 H    5.471400      -2.043100       2.030100    


%chk=000059264-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059264

0 1
S -0.536667 1.482112 0.763808
O 4.504636 2.317778 -0.295385
C 2.227394 1.716751 0.189609
C 3.481106 1.288493 -0.655227
C 1.000053 0.847018 -0.154910
C -4.351233 -0.066692 -0.264070
C -3.230205 0.715907 0.461238
C -5.743214 0.158897 0.369678
C -1.845237 0.465096 -0.158815
C 2.539994 1.705310 1.702504
C -6.875100 -0.607521 -0.351138
C 3.231597 1.370294 -2.183187
C -8.264341 -0.390131 0.291707
C 3.971901 -0.060523 -0.287399
C -9.391447 -1.155590 -0.434818
C 4.414003 -1.174955 0.024379
C 4.915556 -2.488067 0.339049
C 4.794116 -3.541784 -0.755075
C 5.470685 -2.761001 1.558484
H 2.017227 2.760340 -0.121915
H 1.167631 -0.205085 0.138348
H 0.759931 0.893381 -1.230901
H -4.381291 0.234066 -1.332110
H -4.114314 -1.151052 -0.249948
H -3.209892 0.427544 1.530945
H -3.458150 1.800178 0.428446
H -5.713460 -0.148775 1.435744
H -5.975541 1.244325 0.365665
H -1.564582 -0.601123 -0.079621
H -1.826386 0.763725 -1.223170
H 2.711691 0.673228 2.060204
H 1.695345 2.127022 2.275040
H 3.442352 2.303330 1.906774
H -6.640915 -1.692861 -0.354723
H -6.912316 -0.294235 -1.415643
H 2.524819 0.596569 -2.528734
H 4.179969 1.223413 -2.731345
H 2.830975 2.367676 -2.436149
H -8.226367 -0.705475 1.354447
H -8.496492 0.694494 0.297976
H 5.374400 2.032604 -0.677834
H -9.198613 -2.245179 -0.427996
H -9.469652 -0.836466 -1.491430
H -10.373183 -0.983324 0.043634
H 3.735762 -3.692554 -1.038308
H 5.208211 -4.508365 -0.421818
H 5.331979 -3.224540 -1.667752
H 5.856249 -3.759556 1.792767
H 5.548315 -1.993797 2.335674


