%chk=000106530.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106530

0 1
 S   -3.760600      -3.143400      0.2128000    
 O   -2.461500      0.4981000      3.9700001E-02
 O    1.070500      -1.485800     -9.3900003E-02
 O   -3.328600     -0.7956000      -1.658400    
 O  -0.1023000     -0.8911000       1.801000    
 C  -0.7087000       2.848400      0.4034000    
 C    4.555800     -2.7999999E-03 -0.3270000    
 C   -2.202600       2.886000      4.2900000E-02
 C    3.292200     -0.7977000     -0.6936000    
 C   -2.673300       1.672600     -0.7501000    
 C    2.180200     -0.6949000      0.3435000    
 C   0.1329000       2.791800     -0.8736000    
 C  -0.2833000       4.049000       1.249700    
 C    5.126900     -0.5160000      0.9970000    
 C    5.627500     -7.7699997E-02  -1.415400    
 C   -2.513400      -1.822900      0.4024000    
 C   -1.101600      -2.344400      0.1225000    
 C   -2.838300     -0.6811000     -0.5428000    
 C  -1.2000000E-02  -1.492500      0.7398000    
 H  -0.5016000       1.945500      0.9908000    
 H    4.282800       1.052300     -0.1984000    
 H   -2.428600       3.796500     -0.5254000    
 H   -2.777500       2.938600      0.9764000    
 H    3.542200      -1.855400     -0.8505000    
 H    2.905800     -0.4464000      -1.659200    
 H   -3.747100       1.774500     -0.9476000    
 H   -2.155400       1.584600      -1.710300    
 H    1.863600      0.3483000      0.4556000    
 H    2.508400      -1.082200       1.312800    
 H    1.199500       2.877200     -0.6363000    
 H   6.3999998E-03   1.841200      -1.400300    
 H  -0.1226000       3.606400      -1.559600    
 H  -0.8625000       4.090900       2.178000    
 H   0.7762000       3.982700       1.518600    
 H  -0.4396000       4.989300      0.7102000    
 H    5.291000      -1.598700      0.9704000    
 H    4.468700     -0.2852000       1.839700    
 H    6.089100     -3.7900001E-02   1.212600    
 H    5.958300      -1.109600      -1.575200    
 H    6.502500      0.5228000      -1.145500    
 H    5.239100      0.3041000      -2.365300    
 H   -2.612600      -1.467600       1.433900    
 H  -0.9606000      -3.349400      0.5395000    
 H  -0.9348000      -2.405100     -0.9607000    
 H   -4.819800      -2.410300      0.5866000    


%chk=000106530-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000106530

0 1
S -3.461592 -2.667857 -0.234055
O -3.344227 0.645516 0.229807
O 1.598622 -1.614635 -0.419076
O -1.998484 0.314730 -1.658908
O 0.328557 -0.037056 0.733361
C -1.598595 3.214615 0.544487
C 5.380566 -0.920534 -0.500180
C -3.142845 3.081233 0.637435
C 4.015642 -1.647781 -0.648681
C -3.770752 2.000394 -0.251925
C 2.842222 -0.849220 -0.080903
C -1.136884 3.650960 -0.867070
C -1.101768 4.216336 1.614157
C 5.754516 -0.668214 0.981646
C 6.489379 -1.734143 -1.208614
C -2.093330 -1.381546 0.137441
C -0.769251 -1.958140 -0.375911
C -2.439756 -0.066150 -0.551325
C 0.404096 -1.085973 0.049083
H -1.147007 2.226743 0.766559
H 5.300716 0.064652 -1.008326
H -3.608677 4.050501 0.356797
H -3.433208 2.881427 1.687986
H 4.066227 -2.633463 -0.145067
H 3.819710 -1.842785 -1.720636
H -4.869866 1.991363 -0.158892
H -3.481760 2.099329 -1.311959
H 2.761116 0.156510 -0.534328
H 2.884677 -0.734207 1.016359
H -0.040341 3.791540 -0.886547
H -1.384397 2.893904 -1.632144
H -1.605872 4.612946 -1.154754
H -1.399606 3.901360 2.632089
H 0.000492 4.298608 1.594100
H -1.519311 5.226706 1.433765
H 5.776515 -1.621354 1.544782
H 5.040049 0.008161 1.485379
H 6.756909 -0.208298 1.058595
H 6.614575 -2.724246 -0.729202
H 7.461198 -1.209605 -1.157013
H 6.248517 -1.902296 -2.274788
H -2.073949 -1.226862 1.226300
H -0.612573 -2.981426 0.010608
H -0.778621 -2.020511 -1.478977
H -4.460931 -1.984133 0.439246


