%chk=000132859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132859

0 1
 S   -7.364200      -2.352700      0.7428000    
 O    1.950700       2.060200      0.6111000    
 O   -6.625500     -0.9088000      0.5566000    
 O    6.666200      -2.124300     -0.7703000    
 O   -4.051800     -0.2064000     -0.3955000    
 O   -6.796500      -3.307600     -0.1872000    
 O   -8.794200      -2.151000      0.8594000    
 N    3.732100      -2.256600      -1.101500    
 N  -0.5559000       3.385100     -0.1356000    
 N    1.190000      0.2027000     -0.5651000    
 N   -3.894400       2.137800     -0.4181000    
 N    6.299600     -0.8322000       1.093200    
 C  -0.2960000       2.040200     -9.1799997E-02
 C    4.464500      -1.325700     -0.4120000    
 C    2.351400     -0.5806000     -0.6357000    
 C   -2.516300       2.354000     -0.2964000    
 C    3.630200     -0.2722000     -0.1096000    
 C    2.443100      -1.813300      -1.243600    
 C   -1.498200       1.374800     -0.1899000    
 C   -1.905500       3.588100     -0.2602000    
 C    1.009800       1.468800      3.6100000E-02
 C    5.851300      -1.462100     -8.5900001E-02
 C    7.662700     -0.9044000       1.568500    
 C    4.226500      -3.519200      -1.605100    
 C   0.4304000       4.440800     -6.6399999E-02
 C    8.529000      0.2232000       1.020400    
 C   -6.055900       1.119400     -0.5983000    
 C   -4.551900      0.9116000     -0.4583000    
 C   -6.837500     -0.1847000     -0.6485000    
 C    8.028000       1.601500       1.428000    
 C   -6.721900      -2.706000       2.359000    
 H    3.926300      0.6188000      0.4257000    
 H    1.700700      -2.406100      -1.762100    
 H   -1.619900      0.3009000     -0.1755000    
 H   -2.319300       4.586700     -0.3124000    
 H   0.3909000     -0.2184000      -1.033300    
 H   -4.452500       2.986200     -0.4819000    
 H    8.091200      -1.871700       1.285900    
 H    7.626500     -0.8614000       2.662300    
 H    3.387600      -4.116900      -1.971900    
 H    4.721800      -4.054600     -0.7912000    
 H    4.919500      -3.317000      -2.425400    
 H  -4.8500001E-02   5.398900     -0.2859000    
 H    1.207400       4.248600     -0.8106000    
 H   0.8452000       4.461600      0.9442000    
 H    5.637200     -0.3117000       1.660400    
 H    8.566900      0.1681000     -7.4100003E-02
 H    9.554400      9.4300002E-02   1.385700    
 H   -6.245900       1.699000      -1.508500    
 H   -6.386300       1.709400      0.2654000    
 H   -7.906200      2.7899999E-02 -0.7593000    
 H   -6.510100     -0.7949000      -1.497600    
 H    7.037100       1.807500       1.011300    
 H    7.970100       1.691200       2.517300    
 H    8.711400       2.373600       1.060400    
 H   -7.115000      -3.674000       2.676600    
 H   -5.632300      -2.744900       2.305800    
 H   -7.049600      -1.925700       3.048400    


%chk=000132859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132859

0 1
S -6.746224 -2.306527 0.942705
O 1.786597 1.961530 0.728467
O -7.070900 -0.475861 0.550755
O 6.405421 -2.646361 -0.176163
O -4.230889 -0.184188 -0.854723
O -6.745116 -3.137693 -0.451151
O -7.744519 -2.692367 2.148086
N 3.555458 -2.426453 -0.839189
N -0.807281 3.269836 0.266007
N 0.986112 0.107110 -0.463869
N -4.163454 2.124941 -0.514447
N 6.218531 -0.732128 1.144103
C -0.534719 1.916169 0.018685
C 4.280642 -1.473081 -0.106983
C 2.158780 -0.680929 -0.443171
C -2.777297 2.275571 -0.260765
C 3.425643 -0.376104 0.144732
C 2.265797 -1.953451 -1.043410
C -1.754269 1.278670 -0.306960
C -2.166376 3.495906 0.093778
C 0.830510 1.355389 0.133923
C 5.699643 -1.675017 0.266726
C 7.627629 -0.750302 1.566456
C 4.035398 -3.734742 -1.322599
C 0.161837 4.320240 0.632321
C 8.504067 0.300148 0.840531
C -6.315041 1.109983 -1.122339
C -4.820812 0.942061 -0.813144
C -7.103172 -0.186286 -0.897550
C 8.070940 1.757647 1.108367
C -4.966877 -2.135806 1.583067
H 3.653889 0.553591 0.658525
H 1.527613 -2.540066 -1.587101
H -1.926574 0.226433 -0.515850
H -2.596653 4.486030 0.232313
H 0.189804 -0.265280 -0.983919
H -4.730705 2.973978 -0.469530
H 8.004959 -1.765413 1.353466
H 7.673194 -0.584208 2.661117
H 3.198931 -4.245015 -1.828607
H 4.394509 -4.350555 -0.483199
H 4.877552 -3.604535 -2.018903
H -0.372513 5.283201 0.683968
H 0.965914 4.384016 -0.117922
H 0.629353 4.092069 1.601787
H 5.608243 0.005841 1.495613
H 8.480744 0.090378 -0.245558
H 9.551491 0.155434 1.173144
H -6.429364 1.399794 -2.187505
H -6.753985 1.923076 -0.513546
H -8.155574 -0.065320 -1.213142
H -6.650866 -1.023594 -1.464195
H 7.049761 1.949499 0.728988
H 8.083798 1.986562 2.191558
H 8.747652 2.472586 0.606478
H -4.630891 -3.154674 1.822325
H -4.413736 -1.663965 0.757119
H -5.034208 -1.491965 2.470130


