%chk=000106913.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106913

0 1
 S    2.421000      -2.654400      0.7548000    
 O    2.062000      0.3698000      0.2372000    
 O    1.753900       1.819100      -1.530200    
 C   -2.471000     -0.7273000     -0.3598000    
 C   -1.416900      0.4086000     -0.5115000    
 C  -0.7332000      0.9179000      0.7841000    
 C   -2.937400      -1.134100      -1.773500    
 C   -1.849500      -1.964700      0.3122000    
 C   -3.701100     -0.2851000      0.4440000    
 C   0.3530000       1.963200      0.4539000    
 C   -1.752400       1.571500       1.727600    
 C    1.464600       1.411700     -0.4136000    
 C    3.116200     -0.2808000     -0.4795000    
 C    3.690900      -1.415300      0.3542000    
 H   -1.883100       1.261200      -1.024700    
 H  -0.6363000      4.3400001E-02  -1.191800    
 H  -0.2575000      8.1299998E-02   1.307400    
 H   -3.665400      -1.952500      -1.735900    
 H   -3.410500     -0.2907000      -2.289100    
 H   -2.094700      -1.471800      -2.387500    
 H   -1.567100      -1.766500       1.351100    
 H  -0.9535000      -2.296100     -0.2240000    
 H   -2.557100      -2.801800      0.3248000    
 H   -3.563600     -0.3673000       1.522800    
 H   -4.015700      0.7303000      0.1838000    
 H   -4.554500     -0.9395000      0.2232000    
 H   0.8157000       2.356400       1.367300    
 H  -8.9800000E-02   2.818500     -7.1300000E-02
 H   -2.242700      0.8340000       2.363300    
 H   -1.247500       2.247900       2.428300    
 H   -2.495400       2.168800       1.191300    
 H    2.732400     -0.6610000      -1.434300    
 H    3.908900      0.4479000     -0.6864000    
 H    4.075300      -1.027400       1.302700    
 H    4.510200      -1.905800     -0.1794000    
 H    2.145900      -3.008800     -0.5091000    


%chk=000106913-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000106913

0 1
S 1.788587 -2.273660 -1.165628
O 2.287486 0.540022 0.503892
O 1.799530 1.384416 -1.622614
C -2.462934 -0.811716 -0.188395
C -1.439617 0.357075 -0.419386
C -0.738091 1.003944 0.807998
C -2.560936 -1.601282 -1.526223
C -1.972708 -1.781501 0.918986
C -3.885402 -0.288511 0.156869
C 0.379977 1.984995 0.318681
C -1.686808 1.776768 1.754860
C 1.522439 1.301594 -0.405014
C 3.450922 -0.198424 -0.041225
C 3.197838 -1.706987 -0.034966
H -1.945857 1.156483 -1.002143
H -0.642272 -0.044515 -1.075863
H -0.235208 0.206652 1.388568
H -3.327613 -2.396672 -1.460461
H -2.836851 -0.930899 -2.362801
H -1.592531 -2.075548 -1.773276
H -1.956843 -1.297434 1.913255
H -0.953221 -2.148571 0.695824
H -2.644498 -2.658409 0.986311
H -3.913041 0.267187 1.109474
H -4.260363 0.383760 -0.638619
H -4.592913 -1.135696 0.243245
H 0.796127 2.510337 1.198401
H -0.051838 2.734053 -0.368636
H -2.397837 1.099422 2.256806
H -1.115836 2.300807 2.545003
H -2.275450 2.533162 1.200640
H 3.674777 0.177248 -1.056569
H 4.288571 0.040409 0.638809
H 2.896764 -2.049664 0.968243
H 4.123016 -2.233969 -0.327049
H 2.236734 -1.624276 -2.304597


