%chk=000115819.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115819

0 1
 S    3.608200       1.309300      1.6899999E-02
 O    3.027800       2.565200      0.8778000    
 O    1.782500      -2.131000      0.3676000    
 O    3.540000       1.630900      -1.392700    
 O    4.825500      0.8332000      0.6392000    
 O    3.753800      -1.485900     -0.6401000    
 C  -0.2830000      6.8000004E-02  0.3275000    
 C   -1.550200      0.5707000     -0.3691000    
 C    1.011300      0.5932000     -0.3043000    
 C   -2.806600      1.7800000E-02  0.3090000    
 C    2.302300      0.1638000      0.3962000    
 C   -4.109300      0.5108000     -0.3270000    
 C   -5.363800     -9.7800002E-02  0.3040000    
 C   -6.628300      0.3726000     -0.4163000    
 C    2.728300      -1.227000     -2.3700001E-02
 C   -7.881500     -0.2022000      0.2248000    
 C    2.043000      -3.491800      1.0300000E-02
 H  -0.3013000      -1.025100      0.3092000    
 H  -0.3089000      0.3682000       1.382400    
 H   -1.572700       1.666600     -0.3459000    
 H   -1.536600      0.2682000      -1.422900    
 H   0.9367000       1.687800     -0.3191000    
 H    1.039500      0.2799000      -1.356600    
 H   -2.801300      0.2970000       1.369900    
 H   -2.782000      -1.078400      0.2703000    
 H    2.202100      0.1713000       1.487900    
 H   -4.156300       1.604000     -0.2495000    
 H   -4.093300      0.2702000      -1.397500    
 H   -5.411900      0.1826000       1.363000    
 H   -5.303100      -1.191900      0.2611000    
 H   -6.684200       1.467200     -0.3940000    
 H   -6.591500      7.0699997E-02  -1.469500    
 H   -7.872200      -1.296300      0.1919000    
 H   -7.965400      0.1096000       1.270800    
 H   -8.772900      0.1463000     -0.3060000    
 H    3.090700       2.474200       1.857700    
 H    1.216100      -4.104200      0.3794000    
 H    2.970700      -3.835200      0.4777000    
 H    2.096900      -3.593500      -1.077800    


%chk=000115819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115819

0 1
S 3.589969 1.090445 -0.039177
O 3.833154 1.525768 1.759504
O 3.130008 -2.079602 0.879935
O 3.153395 2.429338 -0.834111
O 4.864246 0.251122 -0.573621
O 2.006808 -1.964091 -1.166207
C -0.546893 -0.054674 0.307074
C -1.801412 0.570256 -0.345245
C 0.760318 0.559813 -0.266751
C -3.117995 -0.016600 0.210956
C 1.974324 -0.061487 0.398452
C -4.378500 0.599597 -0.437440
C -5.697022 0.018407 0.121017
C -6.958876 0.633589 -0.526441
C 2.347510 -1.454183 -0.076108
C -8.271705 0.048649 0.037772
C 3.682379 -3.405227 0.500199
H -0.553827 -1.148710 0.133439
H -0.584820 0.103325 1.404221
H -1.791161 1.668337 -0.186615
H -1.761388 0.410447 -1.442052
H 0.756951 1.652719 -0.100630
H 0.801961 0.384854 -1.356752
H -3.156900 0.141949 1.309049
H -3.125943 -1.115326 0.053717
H 2.016654 0.023065 1.495894
H -4.369509 1.699167 -0.284900
H -4.342774 0.437715 -1.535026
H -5.734337 0.180166 1.218850
H -5.708031 -1.081278 -0.031350
H -6.946688 1.732383 -0.374979
H -6.921235 0.471034 -1.623062
H -8.322556 -1.044025 -0.129018
H -8.347828 0.224582 1.127541
H -9.157861 0.504807 -0.440697
H 4.627554 2.129749 1.828033
H 4.256422 -3.729538 1.378109
H 4.332260 -3.291413 -0.382820
H 2.862445 -4.106128 0.271839


