%chk=000020107.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020107

0 1
 S    6.984500      -1.510600     -0.2571000    
 S   -6.978700      -1.517900      0.2472000    
 O  -0.3981000       2.794900       1.386300    
 O   0.3547000       2.847400      -1.374600    
 O    5.961000     -0.3870000      0.3392000    
 O   -5.958600     -0.3804000     -0.3279000    
 O    7.043600      -1.390900      -1.699700    
 O    6.742500      -2.779400      0.3992000    
 O   -7.018400      -1.442300       1.693400    
 O   -6.750700      -2.766900     -0.4507000    
 N    2.407900      0.5676000      0.4393000    
 N   -2.403200      0.5637000     -0.4462000    
 C   0.1929000       1.660400      0.7466000    
 C  -0.1873000       1.681800     -0.7487000    
 C    1.701100       1.694500       1.032400    
 C   -1.699900       1.705900      -1.014000    
 C    3.835900      0.6442000      0.7162000    
 C   -3.834400      0.6540000     -0.7015000    
 C    4.573100     -0.5112000      5.7900000E-02
 C   -4.567600     -0.5182000     -6.9100000E-02
 C    8.471100     -0.8141000      0.4170000    
 C   -8.471200     -0.7956000     -0.3853000    
 H  -0.2267000      0.7648000       1.219000    
 H   0.2425000      0.8081000      -1.251700    
 H    2.114100       2.644900      0.6697000    
 H    1.848500       1.697000       2.120200    
 H   -1.859200       1.733200      -2.100200    
 H   -2.117500       2.645500     -0.6284000    
 H    2.264800      0.5593000     -0.5694000    
 H   -2.247500      0.5247000      0.5599000    
 H    4.256000       1.589500      0.3495000    
 H    4.022300      0.6169000       1.797000    
 H   -4.035300      0.6605000      -1.780000    
 H   -4.246000       1.589000     -0.3005000    
 H  -0.2071000       2.729100       2.337500    
 H   0.1666000       2.786000      -2.326600    
 H    4.211100      -1.470000      0.4465000    
 H    4.425900     -0.4944000      -1.028300    
 H   -4.214700      -1.466000     -0.4916000    
 H   -4.406100     -0.5353000       1.015000    
 H    8.389600     -0.7919000       1.505400    
 H    9.308800      -1.447500      0.1182000    
 H    8.603300      0.1928000      1.6700000E-02
 H   -8.404000     -0.7404000      -1.473500    
 H   -9.307500      -1.434900     -9.4899997E-02
 H   -8.594000      0.1991000      4.7400001E-02


%chk=000020107-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020107

0 1
S 7.138505 -1.418480 -0.516692
S -7.140769 -1.425069 0.494660
O -0.740364 2.390095 1.424956
O 0.741050 2.410820 -1.382520
O 5.864028 -0.733884 0.684211
O -5.864677 -0.720487 -0.692434
O 6.999399 -0.604453 -1.914356
O 7.133943 -3.035417 -0.526656
O -7.009945 -0.628941 1.903326
O -7.130206 -3.041999 0.483679
N 2.539603 0.883279 0.288288
N -2.539501 0.888022 -0.269019
C 0.151687 1.401648 0.770711
C -0.151228 1.412902 -0.743089
C 1.630484 1.715654 1.100466
C -1.629868 1.732149 -1.068425
C 3.903221 0.685650 0.806055
C -3.903033 0.699162 -0.790351
C 4.527202 -0.526343 0.082899
C -4.528726 -0.522817 -0.085775
C 8.615450 -0.786917 0.490210
C -8.616131 -0.785748 -0.509689
H -0.097103 0.386578 1.140377
H 0.097487 0.403429 -1.127763
H 1.785390 2.808033 0.956242
H 1.809229 1.483976 2.170301
H -1.808409 1.516461 -2.141640
H -1.784500 2.822286 -0.907986
H 2.522133 1.215852 -0.686103
H -2.522218 1.206136 0.710198
H 4.578047 1.564712 0.686686
H 3.843160 0.461267 1.887295
H -3.842492 0.490694 -1.874749
H -4.577158 1.576961 -0.658435
H -0.462008 2.500974 2.368450
H 0.462727 2.535885 -2.324242
H 3.903894 -1.425008 0.229491
H 4.633164 -0.313108 -1.001057
H -3.905777 -1.419664 -0.244511
H -4.636266 -0.325317 1.000987
H 8.509198 -1.232208 1.487893
H 9.513819 -1.137356 -0.036103
H 8.527371 0.306387 0.506189
H -8.504865 -1.218207 -1.512452
H -9.515195 -1.145647 0.008991
H -8.531649 0.307956 -0.511713


