%chk=000084117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084117

2 1
 S   -2.248100      -2.491700      0.1810000    
 S    2.206400       2.475200     -7.8199998E-02
 O   -1.428500      -2.693600      -1.217000    
 O    1.367500       2.580400       1.319000    
 O   -1.290600      -2.640300       1.264500    
 O   -3.448000      -3.308900      0.1276000    
 O    3.372700       3.332300      5.6600001E-02
 O    1.277100       2.646700      -1.181600    
 N   -5.943700       1.014300     -0.1813000    
 N    5.968300     -0.9723000      0.1330000    
 N   -7.009400       1.218500     -0.3069000    
 N    7.036100      -1.162500      0.2621000    
 C   -1.875900      0.2361000      0.3006000    
 C    1.907200     -0.2507000     -0.3541000    
 C   -2.775800     -0.8204000      0.1601000    
 C    2.768100      0.8162000     -0.1463000    
 C  -0.4464000      1.0800000E-02  0.4728000    
 C   0.4592000     -4.2199999E-02 -0.5303000    
 C   -2.336600       1.552500      0.2796000    
 C    2.378400      -1.554500     -0.4024000    
 C   -4.136700     -0.5603000     -1.7000000E-03
 C    4.132200      0.5743000      1.6799999E-02
 C   -4.597500      0.7561000     -2.2800000E-02
 C    4.619300     -0.7320000     -2.9700000E-02
 C   -3.697400       1.812500      0.1178000    
 C    3.742300      -1.796400     -0.2392000    
 H  -0.1160000     -9.5200002E-02   1.503900    
 H   0.1341000      6.5399997E-02  -1.562900    
 H   -1.649800       2.388700      0.3885000    
 H    1.709900      -2.395800     -0.5629000    
 H   -4.861400      -1.361500     -0.1165000    
 H    4.837400       1.383600      0.1844000    
 H   -4.048700       2.840700      0.1028000    
 H    4.114100      -2.816900     -0.2759000    
 H  -0.4912000      -2.394400      -1.214400    
 H    1.884200       2.395000       2.138200    


%chk=000084117-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084117

2 1
S -2.526246 -2.861241 0.073659
S 2.610528 2.862459 -0.038866
O -2.090599 -2.970860 -1.710373
O 2.176852 2.969536 1.744002
O -1.181416 -3.058438 0.947860
O -3.902128 -3.624727 0.411475
O 3.986417 3.624622 -0.379244
O 1.264691 3.063607 -0.911398
N -5.969480 1.032021 -0.030742
N 6.053785 -1.030846 0.066932
N -7.092039 1.312170 -0.003301
N 7.176327 -1.311416 0.042136
C -1.884793 -0.018012 -0.130199
C 1.968679 0.017899 0.160168
C -2.925179 -0.993271 -0.062450
C 3.008998 0.993679 0.095679
C -0.471836 -0.404179 -0.197727
C 0.555821 0.404597 0.224781
C -2.296950 1.356584 -0.172355
C 2.381047 -1.356530 0.200994
C -4.282220 -0.695777 -0.024765
C 4.366140 0.696567 0.059995
C -4.630073 0.687312 -0.061330
C 4.714294 -0.686528 0.095412
C -3.646950 1.721748 -0.139719
C 3.731216 -1.721249 0.170502
H -0.254722 -1.387322 -0.628643
H 0.338977 1.388080 0.654913
H -1.542693 2.142231 -0.281810
H 1.626902 -2.142647 0.307530
H -5.031548 -1.494791 0.046721
H 5.115402 1.495778 -0.009805
H -3.944629 2.773825 -0.185642
H 4.029044 -2.773330 0.215313
H -2.118579 -3.924351 -2.021618
H 2.199761 3.922502 2.057116


