%chk=000129589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129589

0 1
 S  -6.0000001E-03   3.714700       1.494300    
 O  -2.7000001E-03   2.075700       1.654700    
 O   2.4000001E-03  -1.511000     -0.1729000    
 O    1.264300       4.243300       1.943400    
 O   -1.278600       4.238100       1.942800    
 O    5.886800      -3.927000     -0.1577000    
 O   -5.875100      -3.943300     -0.1587000    
 C  -1.6000000E-03   1.345300      0.3885000    
 C  -3.1999999E-03   2.405800     -0.7066000    
 C    1.259400      0.5019000      0.3594000    
 C   -1.260300      0.4983000      0.3596000    
 C  -5.5999998E-03   3.718600     -0.2383000    
 C    1.194100     -0.8671000      7.2999999E-02
 C   -1.191200     -0.8704000      7.2899997E-02
 C    2.519600       1.074100      0.5856000    
 C   -2.522000       1.066800      0.5865000    
 C  -2.7000001E-03   2.191500      -2.079400    
 C    2.364700      -1.668400      6.3000000E-03
 C   -2.359400      -1.675000      6.0999999E-03
 C  -8.3999997E-03   4.831800      -1.051500    
 C    3.620900      -1.062800      0.2422000    
 C   -3.617200      -1.073300      0.2432000    
 C    3.681200      0.3048000      0.5308000    
 C   -3.681400      0.2940000      0.5324000    
 C  -5.4000001E-03   3.297700      -2.937400    
 C  -8.5000005E-03   4.607000      -2.426500    
 C    2.340300      -3.050800     -0.2840000    
 C   -2.331100      -3.057200     -0.2857000    
 C    4.794100      -1.833300      0.1832000    
 C   -4.788300      -1.847300      0.1850000    
 C    3.514200      -3.804200     -0.3389000    
 C   -3.503000      -3.813800     -0.3410000    
 C    4.740600      -3.195400     -0.1057000    
 C   -4.730900      -3.209000     -0.1055000    
 H    2.617100       2.134300      0.8008000    
 H   -2.622600       2.126700      0.8020000    
 H  -7.9999998E-04   1.187000      -2.490500    
 H  -1.0700000E-02   5.837500     -0.6488000    
 H    4.637300      0.7918000      0.7125000    
 H   -4.638800      0.7781000      0.7149000    
 H  -5.4000001E-03   3.142900      -4.013200    
 H  -1.0700000E-02   5.450000      -3.112200    
 H    1.398600      -3.562700     -0.4721000    
 H   -1.388100      -3.566000     -0.4753000    
 H    5.759500      -1.363400      0.3649000    
 H   -5.754800      -1.380400      0.3678000    
 H    3.460800      -4.865800     -0.5646000    
 H   -3.446700      -4.874800     -0.5683000    
 H    6.642500      -3.344100      2.9600000E-02
 H   -6.632400      -3.362900      2.9899999E-02


%chk=000129589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129589

0 1
S -0.006214 3.806250 1.713471
O -0.002689 1.905371 1.742701
O 0.002403 -1.626184 0.011277
O 1.386315 4.383866 2.302999
O -1.401026 4.378750 2.302607
O 5.916512 -4.077148 -0.145894
O -5.904381 -4.094779 -0.144787
C -0.001930 1.311165 0.338715
C -0.003686 2.486607 -0.658347
C 1.260167 0.477180 0.227321
C -1.261571 0.473449 0.227412
C -0.005937 3.791670 -0.159921
C 1.212470 -0.916118 0.099357
C -1.209757 -0.919700 0.099488
C 2.544751 1.107045 0.324548
C -2.548019 1.099479 0.324803
C -0.003198 2.321239 -2.062960
C 2.397918 -1.723846 0.032203
C -2.392798 -1.730959 0.032566
C -0.007737 4.952247 -0.948576
C 3.679321 -1.062403 0.117269
C -3.676160 -1.073349 0.117798
C 3.719014 0.367351 0.268622
C -3.720084 0.356282 0.269080
C -0.004947 3.460089 -2.897237
C -0.007203 4.768553 -2.349593
C 2.353950 -3.148287 -0.109707
C -2.344597 -3.155267 -0.109256
C 4.872326 -1.848201 0.057646
C -4.866823 -1.862708 0.058421
C 3.527456 -3.896838 -0.166828
C -3.515873 -3.907325 -0.166129
C 4.793567 -3.239255 -0.081427
C -4.783934 -3.253528 -0.080568
H 2.587545 2.191895 0.470182
H -2.594072 2.184198 0.470432
H -0.001443 1.313121 -2.490911
H -0.009456 5.951029 -0.502193
H 4.689644 0.868096 0.352043
H -4.692184 0.854145 0.352637
H -0.004554 3.330864 -3.984596
H -0.008534 5.640759 -3.011049
H 1.382632 -3.645460 -0.170817
H -1.371811 -3.649546 -0.170500
H 5.845084 -1.343752 0.126125
H -5.841074 -1.361169 0.127032
H 3.512178 -4.985061 -0.273412
H -3.497356 -4.995506 -0.272640
H 6.755217 -3.557941 -0.066525
H -6.744623 -3.578068 -0.065385


