%chk=000151037.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151037

0 1
 S    5.002800       1.471100     -0.4360000    
 O   -4.200400       1.909900      -1.513600    
 O   -5.374900       2.409800      0.8301000    
 O    4.131000      0.5828000      0.6198000    
 O    5.468100       2.764200      0.4430000    
 O    6.195600      0.7112000     -0.7607000    
 O    4.128200       1.942100      -1.493800    
 C   -2.619200      0.3940000      0.3844000    
 C   -3.468900     -0.2780000     -0.7133000    
 C   -1.414400     -0.4537000      0.8094000    
 C  -0.4982000     -0.7200000     -0.4287000    
 C   0.7396000      -1.617500     -3.3000000E-02
 C   -2.576900     -0.4276000      -1.953900    
 C   -1.309200      -1.246200      -1.647400    
 C   -4.625500      0.7409000     -0.8186000    
 C   -3.636200      0.8121000       1.448500    
 C   -4.934500       1.074600      0.6587000    
 C  -0.6347000      0.2341000       1.940300    
 C    1.403800      -1.051500       1.230400    
 C    1.801100      -1.660700      -1.181100    
 C   -4.052800      -1.656700     -0.3151000    
 C   0.7732000     -0.2415000       2.096600    
 C   0.3099000      -3.074900      0.2615000    
 C    2.875300      -1.350000       1.388100    
 C    2.850700     -0.5576000      -1.053200    
 C    3.666500     -0.7107000      0.2376000    
 H   -2.200000       1.330000     -1.8200001E-02
 H   -1.779300      -1.409600       1.201600    
 H  -9.9900000E-02  0.2589000     -0.7392000    
 H   -2.262600      0.5548000      -2.327900    
 H   -3.134100     -0.9043000      -2.769400    
 H   -1.595100      -2.290800      -1.497400    
 H  -0.6875000      -1.230400      -2.548300    
 H   -5.501600      0.3451000      -1.341300    
 H   -3.794600      6.9999998E-04   2.168200    
 H   -3.299100       1.692400       2.005700    
 H   -5.719500      0.4135000       1.043800    
 H   -1.166700      8.4899999E-02   2.887600    
 H  -0.5961000       1.317400       1.769200    
 H    1.333000      -1.597000      -2.166700    
 H    2.327400      -2.625600      -1.173900    
 H   -4.673800      -1.611300      0.5844000    
 H   -4.684700      -2.045100      -1.122500    
 H   -3.281400      -2.406200     -0.1207000    
 H    1.318300      0.1605000       2.947400    
 H  -0.4630000      -3.133800       1.033700    
 H  -6.8999998E-02  -3.573500     -0.6363000    
 H    1.154100      -3.677900      0.6171000    
 H    3.257500     -0.9958000       2.353100    
 H    3.014600      -2.437600       1.375900    
 H    3.517600     -0.5950000      -1.922700    
 H    2.328100      0.4054000      -1.086800    
 H    4.547000      -1.337700      4.9500000E-02
 H   -3.758000       2.506600     -0.8876000    
 H   -6.146400       2.537400      0.2522000    
 H    4.753300       3.197100      0.9663000    


%chk=000151037-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151037

0 1
S 5.444633 1.484914 -0.464795
O -4.277099 1.810234 -1.639015
O -5.343171 2.503153 0.665778
O 4.290854 0.603490 0.692893
O 6.403196 2.250360 0.886174
O 6.437022 0.464056 -1.198236
O 4.656493 2.609960 -1.296500
C -2.702316 0.331105 0.367612
C -3.547421 -0.387293 -0.729031
C -1.457202 -0.455950 0.817698
C -0.553033 -0.740786 -0.429371
C 0.729012 -1.571591 -0.042311
C -2.652016 -0.588616 -1.970586
C -1.370238 -1.377965 -1.593443
C -4.713843 0.631213 -0.891105
C -3.749813 0.767036 1.423379
C -5.040949 1.049167 0.600570
C -0.681652 0.327138 1.904901
C 1.403382 -0.937321 1.191347
C 1.781520 -1.551151 -1.215963
C -4.158627 -1.738326 -0.264036
C 0.758977 -0.102738 2.049321
C 0.378863 -3.056775 0.278169
C 2.883506 -1.227499 1.342343
C 2.785896 -0.383342 -1.078898
C 3.693665 -0.651263 0.135154
H -2.331348 1.259960 -0.119341
H -1.773637 -1.426863 1.254533
H -0.192277 0.252326 -0.784825
H -2.391454 0.406482 -2.376966
H -3.197422 -1.132524 -2.767850
H -1.651621 -2.413893 -1.324151
H -0.735549 -1.460051 -2.496672
H -5.596693 0.193549 -1.401612
H -3.927332 -0.032253 2.167644
H -3.457527 1.676593 1.974728
H -5.907776 0.479711 0.985019
H -1.204616 0.239512 2.879043
H -0.699235 1.412934 1.659660
H 1.263626 -1.489265 -2.188396
H 2.342497 -2.508293 -1.229507
H -4.799162 -1.630262 0.630649
H -4.783145 -2.163815 -1.072350
H -3.383809 -2.484098 -0.018250
H 1.324167 0.336387 2.885240
H -0.444661 -3.132808 1.009636
H 0.085101 -3.605798 -0.635337
H 1.253774 -3.579234 0.707966
H 3.285138 -0.806532 2.280978
H 3.080161 -2.317837 1.370961
H 3.391419 -0.274487 -1.998253
H 2.243671 0.567776 -0.920681
H 4.526840 -1.330293 -0.131698
H -4.509846 2.597327 -1.066217
H -6.311821 2.649678 0.522169
H 5.741399 2.588163 1.558633


