%chk=000159663.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159663

0 1
 S    5.008900       1.014800      0.7462000    
 O    3.899800     -0.1815000      0.7179000    
 O   -5.553000       1.995800      0.4629000    
 O    5.181900       1.340700       2.335400    
 O    6.262000      0.4540000      0.2763000    
 O    4.452300       2.192700      0.1071000    
 C  -0.7119000      0.1822000     -0.2927000    
 C   0.6199000     -0.3953000     -0.9012000    
 C   -1.723300     -0.9535000      7.9400003E-02
 C   -2.959400     -0.3027000      0.7067000    
 C    1.208100      -1.401900      0.1392000    
 C   -3.659200      0.6587000     -0.2759000    
 C   -1.374100       1.303600      -1.139500    
 C   -1.083700      -1.983200       1.020300    
 C   0.2310000      -2.535400      0.4734000    
 C   -2.705300       1.815000     -0.5575000    
 C    1.665400      0.7374000      -1.105300    
 C   -4.088800      -1.174500       1.244500    
 C    2.584300      -1.952600     -0.2719000    
 C   0.3516000      -1.066100      -2.273000    
 C   -4.883200      0.9764000      0.5641000    
 C    3.060000      0.2251000      -1.488200    
 C   -5.198200     -0.1520000       1.531900    
 C    3.590700     -0.8267000     -0.5176000    
 C   -4.175700      2.8800000E-02  -1.582700    
 H  -0.4316000      0.6681000      0.6558000    
 H   -2.028900      -1.488600     -0.8254000    
 H   -2.602100      0.2807000       1.573400    
 H    1.365900     -0.8473000       1.077400    
 H   -1.548800      0.9532000      -2.161600    
 H  -0.6955000       2.160200      -1.218500    
 H   -1.773700      -2.818200       1.189200    
 H  -0.8986000      -1.524800       2.000400    
 H   0.6735000      -3.197500       1.227800    
 H   3.8600001E-02  -3.156700     -0.4086000    
 H   -2.505300       2.375200      0.3653000    
 H   -3.159500       2.532700      -1.251600    
 H    1.745400       1.332100     -0.1866000    
 H    1.332400       1.425700      -1.891300    
 H   -3.807700      -1.714100       2.154200    
 H   -4.416000      -1.914100      0.5059000    
 H    2.961500      -2.594900      0.5341000    
 H    2.498500      -2.581200      -1.164800    
 H    1.234100      -1.571900      -2.673400    
 H  -0.4382000      -1.819800      -2.226800    
 H   5.1300000E-02 -0.3273000      -3.023400    
 H    2.986700     -0.2494000      -2.475500    
 H    3.738600       1.058000      -1.666300    
 H   -5.126600      0.2295000       2.554500    
 H   -6.189200     -0.5688000       1.339800    
 H    4.514700      -1.264900     -0.9128000    
 H   -3.376400     -0.3977000      -2.194300    
 H   -4.909700     -0.7640000      -1.403000    
 H   -4.683700      0.7859000      -2.192400    
 H    4.340000       1.448400       2.837300    


%chk=000159663-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159663

0 1
S 5.184608 1.143442 0.824845
O 3.839832 -0.112125 0.792261
O -5.638178 2.097383 0.405704
O 5.767012 0.700982 2.495153
O 6.374924 0.758547 -0.173617
O 4.541465 2.613909 0.833106
C -0.751834 0.168857 -0.346898
C 0.591994 -0.403028 -0.942716
C -1.749775 -0.966773 0.077713
C -2.997391 -0.304669 0.694674
C 1.209935 -1.354399 0.146895
C -3.711436 0.668002 -0.291847
C -1.431256 1.245747 -1.246921
C -1.082584 -1.958079 1.062538
C 0.256637 -2.508526 0.527084
C -2.748465 1.815735 -0.651581
C 1.609300 0.760753 -1.169935
C -4.149581 -1.165128 1.280203
C 2.615220 -1.877400 -0.231516
C 0.342188 -1.140380 -2.288290
C -4.970135 1.041525 0.514672
C 3.022578 0.272359 -1.559874
C -5.283599 -0.119302 1.489210
C 3.603246 -0.739712 -0.560405
C -4.257421 -0.028909 -1.580234
H -0.464871 0.685025 0.600661
H -2.062966 -1.535037 -0.822839
H -2.628763 0.330799 1.535413
H 1.338643 -0.727496 1.056298
H -1.638047 0.822860 -2.249172
H -0.731981 2.087743 -1.404722
H -1.776884 -2.791971 1.283764
H -0.897142 -1.433228 2.024557
H 0.735852 -3.145086 1.298074
H 0.076453 -3.163039 -0.350061
H -2.520645 2.398910 0.263337
H -3.218972 2.516567 -1.366513
H 1.680849 1.366053 -0.243806
H 1.246491 1.435938 -1.966766
H -3.869360 -1.665326 2.222913
H -4.460615 -1.953474 0.569120
H 3.026546 -2.488320 0.593960
H 2.567113 -2.536410 -1.121865
H 1.249391 -1.652670 -2.655968
H -0.448360 -1.906173 -2.208772
H 0.036340 -0.424869 -3.073138
H 3.001519 -0.223222 -2.550498
H 3.708216 1.135465 -1.669460
H -5.274625 0.291785 2.517468
H -6.304672 -0.504014 1.315356
H 4.572521 -1.143038 -0.911202
H -3.443029 -0.466502 -2.181723
H -4.973824 -0.838052 -1.350753
H -4.782383 0.718319 -2.201873
H 4.959722 0.647952 3.086588


