%chk=000166722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166722

0 1
 S    5.348200      0.9765000      0.1627000    
 O    1.906000      -1.658000      0.1724000    
 O    3.950600      0.2173000     -0.2126000    
 O    4.859600       2.277900       1.016600    
 O    6.085000      0.1126000       1.066300    
 O    5.969100       1.452100      -1.059500    
 C   -3.659500     -0.7356000      0.2538000    
 C   -3.496000       1.967200     -0.2241000    
 C   -4.031100      0.7515000      0.6022000    
 C   -2.138300     -0.9875000      0.2310000    
 C   -4.238100      -1.624800       1.392700    
 C   -4.384500      -1.186300      -1.031900    
 C   -3.996800       3.252400      0.4807000    
 C   -4.075300       1.990200      -1.652100    
 C   -1.966500       2.044500     -0.2996000    
 C   -1.418800     -0.7005000       1.361100    
 C   -1.582300      -1.486200     -0.9175000    
 C  -4.2900000E-02 -0.9289000       1.341100    
 C  -0.2064000      -1.714700     -0.9376000    
 C   0.5634000      -1.436000      0.1918000    
 C    2.567200      -1.530500      -1.085600    
 C    3.987400      -1.052900     -0.8519000    
 H   -5.129500      0.8201000      0.6195000    
 H   -3.732400      0.9318000       1.645600    
 H   -5.332600      -1.560200       1.419600    
 H   -3.882300      -1.331000       2.386300    
 H   -3.974500      -2.679900       1.248200    
 H   -4.013100     -0.7057000      -1.937700    
 H   -5.456800     -0.9635000     -0.9707000    
 H   -4.300000      -2.270200      -1.182200    
 H   -3.607600       3.318600       1.503100    
 H   -5.091200       3.272500      0.5366000    
 H   -3.676000       4.154900     -5.2400000E-02
 H   -5.149700       1.778000      -1.653500    
 H   -3.933900       2.973000      -2.117800    
 H   -3.573700       1.272200      -2.305100    
 H   -1.653200       3.006500     -0.7251000    
 H   -1.510200       1.980800      0.6927000    
 H   -1.539000       1.283400     -0.9540000    
 H   -1.865500     -0.2991000       2.263700    
 H   -2.131500      -1.727900      -1.818000    
 H   0.5522000     -0.7077000       2.223000    
 H   0.2219000      -2.137500      -1.841700    
 H    2.071900     -0.7840000      -1.719800    
 H    2.575800      -2.502500      -1.590200    
 H    4.523600     -0.9686000      -1.802600    
 H    4.516200      -1.756300     -0.1998000    
 H    4.119800       2.791500      0.6154000    


%chk=000166722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166722

0 1
S 6.667088 0.272612 -0.074164
O 2.110744 -0.930638 0.485747
O 4.825402 0.009075 0.043762
O 6.391383 2.053615 -0.256930
O 7.433005 0.004374 1.302772
O 7.200071 -0.385271 -1.438526
C -3.688505 -0.714788 0.065475
C -4.200232 1.997310 -0.170217
C -4.279200 0.638116 0.614621
C -2.140106 -0.740094 0.107336
C -4.193963 -1.834373 1.037207
C -4.238615 -1.059365 -1.342056
C -4.529628 3.113898 0.865301
C -5.267938 2.083198 -1.297889
C -2.795622 2.281652 -0.762290
C -1.451134 -0.457310 1.322552
C -1.346539 -1.095829 -1.008465
C -0.051080 -0.522078 1.418069
C 0.065779 -1.167188 -0.938708
C 0.715218 -0.881147 0.283211
C 2.936839 -1.325959 -0.654759
C 4.378623 -1.391449 -0.170455
H -5.354659 0.451292 0.822515
H -3.814006 0.810586 1.606794
H -5.297315 -1.908221 0.999366
H -3.903498 -1.625717 2.082958
H -3.769205 -2.815614 0.757058
H -3.854466 -0.383963 -2.125899
H -5.340824 -0.984599 -1.344136
H -3.973775 -2.095472 -1.626000
H -3.759350 3.161110 1.658291
H -5.508146 2.932463 1.350426
H -4.573364 4.103896 0.373261
H -6.281772 1.889737 -0.897372
H -5.269401 3.097362 -1.741619
H -5.081957 1.364690 -2.112842
H -2.772551 3.295710 -1.206066
H -2.011232 2.229349 0.014457
H -2.526043 1.560311 -1.553311
H -2.016668 -0.182847 2.220201
H -1.822435 -1.325373 -1.966573
H 0.467596 -0.304163 2.356838
H 0.629147 -1.442038 -1.836115
H 2.838818 -0.600631 -1.487340
H 2.637960 -2.333450 -1.016863
H 5.006846 -1.868167 -0.948775
H 4.443402 -1.945822 0.781760
H 5.394009 2.160714 -0.309510


