%chk=000296536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296536

0 1
S 2.775486 -0.918470 0.072472
O 2.733351 0.888240 0.121164
O -1.105765 2.889061 0.126458
O 3.406015 -1.193321 1.322926
O 3.452986 -1.124286 -1.166730
C 0.151596 -0.456298 0.036449
C 0.385541 0.983099 0.081414
C -1.324553 -0.653775 0.004742
C 1.143018 -1.372243 0.028573
C -1.961257 0.620298 0.033733
C -0.912806 1.697486 0.085968
C 1.617930 1.593474 0.116962
C -2.092957 -1.804934 -0.044749
C 0.980635 -2.852448 -0.016761
C -3.336472 0.744753 0.013991
C 1.864146 3.052286 0.149292
C -3.497482 -1.683328 -0.065234
C -4.110463 -0.433555 -0.036491
H -1.624147 -2.793322 -0.067759
H 1.410285 -3.341512 0.873298
H 1.446882 -3.290909 -0.914709
H -0.080563 -3.158509 -0.047112
H -3.810172 1.727559 0.036817
H 2.575441 3.330354 0.944955
H 0.930641 3.633654 0.304695
H 2.310149 3.404586 -0.796983
H -4.106900 -2.587135 -0.104191
H -5.197964 -0.357506 -0.052890


%chk=000296536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296536

0 1
S 2.889481 -0.955209 0.238350
O 2.814844 1.012203 -0.085479
O -1.187318 2.946804 0.266430
O 3.339444 -1.073326 1.783302
O 3.858231 -1.543622 -0.907759
C 0.163454 -0.435683 0.041074
C 0.392917 1.022203 0.126623
C -1.316148 -0.648689 0.028471
C 1.091107 -1.445886 -0.030125
C -1.955821 0.619381 0.122674
C -0.932507 1.706437 0.187834
C 1.618440 1.671047 0.030159
C -2.104081 -1.820767 -0.020718
C 0.949784 -2.928240 -0.254547
C -3.353676 0.751534 0.154050
C 1.823516 3.163183 0.000442
C -3.514230 -1.693643 0.007821
C -4.138487 -0.423006 0.090468
H -1.662181 -2.818152 -0.068885
H 0.578054 -3.448394 0.648541
H 1.914729 -3.384668 -0.534338
H 0.254717 -3.118482 -1.091674
H -3.804122 1.746156 0.229472
H 2.386421 3.475729 0.898959
H 0.851098 3.679407 -0.020683
H 2.430299 3.439773 -0.880031
H -4.134041 -2.596003 -0.031285
H -5.231322 -0.356789 0.111153


