%chk=000111447.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111447

0 1
 S    2.867000       1.936900       1.190900    
 S    1.889800       3.524400      0.3248000    
 O    3.708200      -1.147800     -0.6277000    
 O   -2.624300       1.173400      0.1369000    
 O   0.9842000      -1.092500      -1.363800    
 O   -4.239800     -0.6922000       1.516100    
 O  -0.7636000      -2.852300     -7.0900001E-02
 O   -6.927400     -0.8704000      0.8577000    
 O    4.096100      -1.455000       1.625900    
 O   -1.494600       1.292300      -1.871400    
 C    1.456700      -1.990500     -0.3571000    
 C   -4.789500      0.1602000      0.5088000    
 C    2.911400      -2.336500     -0.6540000    
 C   -3.699800      0.4829000     -0.5072000    
 C   0.5733000      -3.231000     -0.3814000    
 C   -5.957000     -0.5715000     -0.1402000    
 C    5.049900      0.4465000      0.4446000    
 C  -0.5358000       2.236300      0.1560000    
 C    4.182000       1.614600     -8.9999996E-03
 C   0.6501000       2.676600     -0.6944000    
 C    4.242400     -0.8245000      0.5877000    
 C   -1.579400       1.520100     -0.6723000    
 H    1.365300      -1.462800      0.5987000    
 H   -5.128100       1.065600       1.023200    
 H    3.301200      -3.095700      3.4200002E-02
 H    3.003400      -2.740200      -1.668700    
 H   -4.106500       1.114700      -1.305500    
 H   -3.302400     -0.4426000     -0.9419000    
 H   0.5654000      -3.689000      -1.376000    
 H   0.9068000      -3.967000      0.3566000    
 H   -6.427100      4.4799998E-02 -0.9128000    
 H   -5.633600      -1.520400     -0.5810000    
 H    5.528600      0.6644000       1.406900    
 H    5.856200      0.2619000     -0.2743000    
 H  -0.2138000       1.543000      0.9413000    
 H   -1.014600       3.107900      0.6178000    
 H    4.808900       2.507400     -0.1033000    
 H    3.735900       1.403700     -0.9865000    
 H    1.104900       1.836600      -1.230400    
 H   0.3096000       3.385700      -1.457500    
 H   5.2200001E-02 -0.8977000      -1.165800    
 H   -3.921200      -1.502700       1.083100    
 H   -1.301900      -3.661700     -9.5200002E-02
 H   -7.658100      -1.334000      0.4143000    


%chk=000111447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000111447

0 1
S 2.686049 2.317622 1.340656
S 2.081568 3.879997 -0.188528
O 3.087258 -1.275522 -0.176033
O -2.728432 1.820535 -0.457142
O 0.554857 -1.362642 -1.933409
O -2.647688 -0.882273 0.753891
O -1.604574 -2.584233 -1.017023
O -5.130552 -2.031644 1.438845
O 2.992205 -1.553295 2.142856
O -1.095514 0.715627 -1.681262
C 0.696228 -1.862877 -0.557143
C -3.884661 -0.166921 0.437211
C 2.115938 -2.389726 -0.354319
C -3.735041 0.761644 -0.778935
C -0.340630 -3.008645 -0.385752
C -5.039623 -1.181040 0.255638
C 4.478998 0.161120 1.152807
C -0.482005 2.626638 -0.244283
C 4.062471 1.421871 0.368008
C 0.753371 2.895151 -1.116418
C 3.442529 -0.956041 1.141149
C -1.431496 1.627144 -0.875064
H 0.476012 -1.062072 0.176524
H -4.087006 0.445649 1.334000
H 2.170114 -3.052019 0.529377
H 2.451004 -2.910385 -1.265059
H -4.667042 1.317956 -0.971838
H -3.413178 0.218367 -1.685413
H 0.009827 -3.939261 -0.873401
H -0.560555 -3.205877 0.674945
H -6.014636 -0.670264 0.168940
H -4.865837 -1.789269 -0.661084
H 4.711211 0.397448 2.205054
H 5.403179 -0.232828 0.686210
H -0.156924 2.183491 0.720936
H -1.025139 3.554154 0.000200
H 4.905223 2.123167 0.272194
H 3.673388 1.155101 -0.625703
H 1.209112 1.958539 -1.473472
H 0.514000 3.523872 -1.993102
H 0.125705 -0.453296 -1.924198
H -2.357363 -1.504918 -0.003823
H -1.309083 -2.165821 -1.878571
H -4.192268 -2.242326 1.698731


