%chk=000191551.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191551

0 1
S 2.318103 1.674738 -0.136812
O 3.549323 -2.168626 0.039155
O -6.202143 2.239806 1.000903
O 5.307172 -0.387786 0.682868
O 4.613594 -0.098844 -1.423431
C 0.856050 -0.577141 -0.405656
C 1.053616 -2.055740 0.064154
C -0.599474 -0.242206 -0.802126
C -1.633535 -0.694084 0.254007
C -3.106267 -0.358407 -0.157267
C -0.054133 -2.505862 1.042806
C 1.468493 0.285846 0.723727
C -1.458224 -2.201149 0.518988
C 2.393872 -1.999077 0.871961
C -0.759507 1.258313 -1.097938
C 2.393087 -0.611659 1.544884
C -3.219444 1.093932 -0.621112
C 1.154327 -3.014573 -1.119780
C -2.174304 1.575196 -1.587429
C -3.998937 -0.588200 1.094626
C -3.597880 -1.233120 -1.325179
C -5.401835 -0.005752 0.949088
C -4.233639 1.896572 -0.258958
C -5.350230 1.471073 0.605941
C 3.766213 2.190041 0.840986
C 5.005705 1.855360 0.019574
C 4.950340 0.404897 -0.373737
H 1.469847 -0.446681 -1.338749
H -0.807836 -0.808191 -1.747280
H -1.420711 -0.137751 1.200609
H 0.080913 -2.009398 2.023939
H 0.041857 -3.591281 1.239022
H 0.681550 0.734140 1.368591
H -1.645117 -2.779233 -0.406958
H -2.209910 -2.553382 1.251424
H 2.513399 -2.833350 1.592873
H -0.021528 1.581101 -1.859111
H -0.544471 1.863979 -0.194692
H 2.028905 -0.694651 2.586234
H 3.428281 -0.228907 1.648288
H 0.220783 -3.045575 -1.692080
H 1.957450 -2.732744 -1.813027
H 1.375911 -4.036987 -0.789470
H -2.357493 1.102283 -2.576664
H -2.265748 2.666802 -1.768170
H -3.511657 -0.134391 1.981823
H -4.067238 -1.672021 1.309820
H -3.732608 -2.276571 -1.021535
H -4.565195 -0.883097 -1.705486
H -2.890906 -1.221782 -2.162314
H -5.986608 -0.154615 1.879404
H -5.974264 -0.532659 0.158621
H -4.301710 2.933745 -0.592300
H 3.471452 -1.644078 -0.809595
H 3.685821 3.280404 1.017715
H 3.790197 1.699305 1.833020
H 5.064056 2.483137 -0.898383
H 5.929526 2.066566 0.602135
H 5.082707 -1.383863 0.525651


%chk=000191551-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191551

0 1
S 2.075108 2.023160 0.500701
O 3.639634 -2.227641 0.044496
O -6.323070 2.301480 0.847928
O 5.407446 -0.360421 0.397343
O 4.166859 -0.067655 -1.544305
C 0.911865 -0.545665 -0.266312
C 1.104211 -2.057848 0.122851
C -0.539203 -0.212872 -0.736633
C -1.631834 -0.696393 0.263610
C -3.116937 -0.370898 -0.196872
C -0.018529 -2.500009 1.112223
C 1.448773 0.241540 0.974029
C -1.438730 -2.199084 0.591420
C 2.446366 -2.059037 0.918613
C -0.714694 1.288211 -1.057171
C 2.452160 -0.706449 1.696481
C -3.211388 1.093895 -0.659164
C 1.139060 -3.001232 -1.101977
C -2.131113 1.582917 -1.602827
C -4.067298 -0.604042 1.020137
C -3.558641 -1.272982 -1.396290
C -5.474263 0.001968 0.840823
C -4.239056 1.924024 -0.286069
C -5.405596 1.491854 0.508343
C 3.914128 2.204891 0.925575
C 4.889299 1.894987 -0.246942
C 4.815028 0.423494 -0.573686
H 1.588311 -0.312436 -1.114465
H -0.683764 -0.770381 -1.689033
H -1.484863 -0.124384 1.208545
H 0.117418 -1.989229 2.087031
H 0.085637 -3.585843 1.308460
H 0.624583 0.495932 1.661950
H -1.634808 -2.805881 -0.312946
H -2.171758 -2.525508 1.352507
H 2.512505 -2.922098 1.602654
H 0.048080 1.613700 -1.788813
H -0.554362 1.893487 -0.143154
H 2.123751 -0.873896 2.738296
H 3.476628 -0.309668 1.761345
H 0.137064 -3.110837 -1.552102
H 1.810390 -2.628302 -1.896348
H 1.492815 -4.006876 -0.810995
H -2.245507 1.068822 -2.581508
H -2.256843 2.663533 -1.796715
H -3.602508 -0.149747 1.918771
H -4.160735 -1.687830 1.218538
H -3.655563 -2.327155 -1.082732
H -4.538263 -0.948013 -1.789455
H -2.837946 -1.231160 -2.232127
H -6.091445 -0.130909 1.746895
H -6.014453 -0.502853 0.013715
H -4.255352 2.969561 -0.621082
H 3.515162 -1.745210 -0.827392
H 3.995524 3.270432 1.199244
H 4.161839 1.605379 1.816461
H 4.616128 2.480761 -1.138065
H 5.914906 2.156770 0.073027
H 4.987847 -1.306553 0.360766


