%chk=000024712.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024712

0 1
 S   -4.913700       1.126100      0.4586000    
 S    4.741300       1.509000       1.131400    
 O   -2.570300     -0.3663000     -0.8732000    
 O   -6.494900      0.7931000      0.6783000    
 O   -1.821400       2.118700      0.1222000    
 O   -4.689000       1.425900     -0.9430000    
 O   -4.475400       2.025800       1.509100    
 O  -0.6482000      -3.651800     -0.8061000    
 O    2.103400      -3.714000     -0.5275000    
 O    4.214700       2.249500       2.486200    
 O    5.911200       2.214500      0.6394000    
 O    4.762700      7.5599998E-02   1.363100    
 C   -2.795900     -0.6030000      0.5168000    
 C   -2.289900      -2.013900      0.8461000    
 C   -4.290900     -0.4921000      0.8026000    
 C  -0.7859000      -2.066900      0.9792000    
 C    2.411500       1.870800      -2.296000    
 C    3.572600       1.501300      -1.352500    
 C    1.094400       1.282500      -1.917700    
 C   -1.365000      0.1839000      -1.212100    
 C  -0.9939000       1.428800     -0.7115000    
 C    3.362100       1.899300      0.1039000    
 C   0.2383000       1.979000      -1.064800    
 C   0.7186000      3.5500001E-02  -2.417200    
 C  -0.5135000     -0.5149000      -2.063600    
 C  -4.1200001E-02  -2.884900      0.1443000    
 C  -0.1777000      -1.282700       1.947400    
 C    1.346700      -2.919900      0.2808000    
 C    1.210000      -1.318000       2.084100    
 C    1.972200      -2.136600       1.250700    
 C   -1.362200       3.386100      0.5880000    
 C    2.569300      -3.140400      -1.747100    
 H   -2.300200      0.1315000       1.156600    
 H   -2.651900      -2.718400      8.8200003E-02
 H   -2.708100      -2.352000       1.803600    
 H   -4.515700     -0.7169000       1.849900    
 H   -4.848400      -1.180400      0.1572000    
 H    2.325000       2.964400      -2.346000    
 H    2.673400       1.558500      -3.315400    
 H    3.745300      0.4185000      -1.403300    
 H    4.486700       1.973300      -1.733300    
 H    2.500200       1.385300      0.5391000    
 H    3.202600       2.980500      0.1727000    
 H   0.5813000       2.944800     -0.7094000    
 H    1.374000     -0.5127000      -3.088100    
 H  -0.8087000      -1.476000      -2.473800    
 H  -0.7555000     -0.6524000       2.616800    
 H    1.697300     -0.7103000       2.840900    
 H    3.051800      -2.164700       1.365000    
 H   -6.914600      0.2432000     -2.4400000E-02
 H   2.9700000E-02  -4.185000      -1.255400    
 H   -2.142400       3.793900       1.239000    
 H  -0.4590000       3.287500       1.199900    
 H   -1.233900       4.096500     -0.2357000    
 H    4.223400       3.235300       2.461900    
 H    3.273300      -3.840100      -2.206200    
 H    1.735200      -2.985300      -2.437400    
 H    3.089500      -2.195200      -1.561500    


%chk=000024712-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000024712

0 1
S -5.218188 1.063816 0.456822
S 5.003880 0.859822 0.397158
O -2.549529 -0.411586 -0.993646
O -6.898342 0.327170 0.850205
O -2.079804 2.075959 0.154203
O -5.319524 1.815830 -0.967221
O -4.704067 1.886677 1.753911
O -0.532583 -3.570783 -0.755644
O 2.103136 -3.492746 -0.586870
O 4.443185 0.969512 2.178691
O 6.321978 1.775634 0.193938
O 5.057443 -0.698650 -0.048674
C -2.917897 -0.661708 0.424647
C -2.322393 -2.014598 0.911596
C -4.435566 -0.713617 0.426241
C -0.809006 -1.952693 1.051637
C 2.246684 2.471478 -2.415044
C 3.517149 1.779731 -1.825856
C 0.956667 1.743183 -2.059932
C -1.369298 0.304526 -1.279441
C -1.117288 1.601800 -0.741874
C 3.426958 1.715389 -0.301332
C 0.048093 2.302769 -1.125268
C 0.670675 0.474447 -2.618905
C -0.482274 -0.239079 -2.226250
C 0.022664 -2.728897 0.219091
C -0.189670 -1.114159 2.018562
C 1.440929 -2.662303 0.340206
C 1.212810 -1.046402 2.138620
C 2.045442 -1.824044 1.293661
C -2.000898 3.463932 0.619608
C 3.567245 -3.593972 -0.491447
H -2.551077 0.162535 1.062194
H -2.606541 -2.810712 0.202528
H -2.774983 -2.248924 1.896092
H -4.873707 -1.147365 1.337283
H -4.856446 -1.154096 -0.490022
H 2.205508 3.519864 -2.063161
H 2.380851 2.508822 -3.513102
H 3.598348 0.756784 -2.237424
H 4.416990 2.344421 -2.134683
H 2.610923 1.080679 0.079134
H 3.447303 2.695973 0.200260
H 0.248255 3.296552 -0.709399
H 1.351285 0.034372 -3.357177
H -0.712486 -1.228626 -2.632398
H -0.821487 -0.512654 2.683633
H 1.675598 -0.390325 2.883027
H 3.133568 -1.759222 1.378390
H -7.571539 1.063244 0.787063
H 0.219299 -4.040387 -1.208808
H -2.905955 3.592761 1.230053
H -1.095362 3.626736 1.235832
H -2.009836 4.164879 -0.236194
H 5.233775 0.764580 2.756577
H 3.864803 -4.259260 -1.315238
H 4.044963 -2.603806 -0.603552
H 3.859639 -4.039465 0.478497


