%chk=000138167.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138167

0 1
 S   0.8488000      0.3582000      -1.067100    
 S  -0.7476000      0.5194000       1.436100    
 O    3.263200      -4.185600     -0.7649000    
 O   -5.177200      -1.888400      0.3647000    
 O    2.891200      -3.077800       1.182100    
 O   -4.189000     -0.7354000      -1.323700    
 C   0.3374000       1.479700      0.3024000    
 C  -0.4597000       2.673200     -0.2564000    
 C    1.569300       1.962800       1.090500    
 C   0.4084000       3.672900      -1.027600    
 C    2.430100       2.963400      0.3129000    
 C    1.602900       4.137400     -0.2009000    
 C    1.640000     -0.9052000     -5.2000001E-02
 C   -2.038600      0.1211000      0.2417000    
 C    2.148400      -2.073200     -0.8857000    
 C   -3.123400     -0.7606000      0.8444000    
 C    2.789600      -3.145100     -3.6400001E-02
 C   -4.193700      -1.116800     -0.1600000    
 H   -1.254400       2.366200     -0.9439000    
 H  -0.9423000       3.220000      0.5656000    
 H    2.197800       1.164500       1.490900    
 H    1.215300       2.498300       1.985200    
 H   0.7615000       3.226500      -1.964500    
 H  -0.1996000       4.541400      -1.307300    
 H    3.225000       3.341400      0.9667000    
 H    2.928100       2.464400     -0.5262000    
 H    2.235400       4.797200     -0.8054000    
 H    1.246600       4.731200      0.6500000    
 H    2.510200     -0.4893000      0.4599000    
 H   0.9635000      -1.318300      0.6981000    
 H   -1.644500     -0.3998000     -0.6331000    
 H   -2.531200       1.036600     -9.5399998E-02
 H    2.898900      -1.726500      -1.605700    
 H    1.318200      -2.538900      -1.429900    
 H   -3.610500     -0.2446000       1.680100    
 H   -2.689000      -1.699600       1.207300    
 H    3.684500      -4.867300     -0.1991000    
 H   -5.868200      -2.102100     -0.2980000    


%chk=000138167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138167

0 1
S 0.983073 0.478812 -1.062497
S -0.923902 0.748490 1.438743
O 2.615969 -4.437035 -0.783319
O -4.802222 -2.520802 0.353255
O 3.258294 -3.121533 1.020133
O -4.566160 -0.792645 -1.180923
C 0.323686 1.662883 0.296215
C -0.357065 2.841352 -0.439550
C 1.448956 2.157428 1.234887
C 0.661637 3.767275 -1.153819
C 2.466034 3.066036 0.504316
C 1.757517 4.258773 -0.179864
C 1.834847 -0.836881 -0.006603
C -2.262840 0.256371 0.198105
C 1.908748 -2.139506 -0.816740
C -3.025687 -0.952808 0.758662
C 2.660028 -3.227872 -0.072259
C -4.177712 -1.364198 -0.139317
H -1.102941 2.462069 -1.162892
H -0.909981 3.422969 0.325155
H 1.959515 1.299748 1.710142
H 0.966911 2.734067 2.051775
H 1.133868 3.223135 -1.994172
H 0.117206 4.627387 -1.588961
H 3.215749 3.426903 1.234234
H 3.006530 2.471833 -0.258247
H 2.495206 4.881223 -0.721448
H 1.297414 4.905657 0.596212
H 2.841045 -0.489593 0.274874
H 1.221682 -0.964802 0.902436
H -1.748148 0.002978 -0.745052
H -2.939569 1.107824 0.029038
H 2.419310 -1.982447 -1.787306
H 0.898517 -2.513852 -1.065222
H -3.441399 -0.738076 1.762743
H -2.354235 -1.821460 0.890959
H 3.122960 -5.131494 -0.280881
H -5.557441 -2.766908 -0.247411


