%chk=000162217.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162217

0 1
 S   0.7463000      -2.485000      4.6799999E-02
 O  -0.4352000      -3.124700     -0.8769000    
 O    2.004400      -2.710300     -0.6385000    
 O   0.5453000      -2.914300       1.416600    
 C  -0.8894000     -0.3218000      1.3700000E-02
 C   -1.184500       1.038200     -4.1999999E-03
 C   -2.013800      -1.310300      2.3700001E-02
 C   -2.598100       1.522700     -1.3300000E-02
 C   0.4389000     -0.7483000      2.2900000E-02
 C    1.490400      0.1827000      1.4000000E-02
 C  -0.1525000       1.976900     -1.3100000E-02
 C    1.190300       1.565800     -4.3000001E-03
 C   -2.885700      -1.214500      -1.240000    
 C   -2.891200      -1.182800       1.280700    
 C   -2.934800       2.323300      -1.284200    
 C   -2.940900       2.353400       1.236500    
 C    2.833100     -0.2285000      2.2900000E-02
 C    2.241900       2.496700     -1.3000000E-02
 C    3.865200      0.7103000      1.3900000E-02
 C    3.570200       2.070300     -4.0000002E-03
 H   -1.767100      -2.340400      0.2017000    
 H   -3.352400      0.7607000     -4.9899999E-02
 H  -0.3798000       3.041100     -2.7000001E-02
 H   -3.908100     -0.8670000      -1.062400    
 H   -3.002600      -2.223800      -1.656500    
 H   -2.426200     -0.6233000      -2.038600    
 H   -2.270700      -1.051500       2.176000    
 H   -3.445400      -2.121600       1.425700    
 H   -3.668200     -0.4215000       1.306700    
 H   -2.369200       3.259800      -1.339300    
 H   -3.999200       2.583800      -1.305900    
 H   -2.712400       1.747900      -2.189000    
 H   -2.729900       1.791600       2.152900    
 H   -4.004200       2.618100       1.242800    
 H   -2.370700       3.287700       1.278000    
 H    3.188800      -1.236200      0.1622000    
 H    2.034900       3.564800     -2.5300000E-02
 H    4.900200      0.3819000      4.8799999E-02
 H    4.374100       2.800600     -4.3000001E-03
 H  -0.3836000      -2.910500      -1.838400    


%chk=000162217-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162217

0 1
S 0.774292 -2.582872 0.168446
O 0.053573 -3.073606 -1.495400
O 2.340873 -2.992082 0.091502
O -0.078901 -3.281569 1.354177
C -0.982699 -0.334774 0.022518
C -1.268675 1.095037 0.014157
C -2.118964 -1.377375 -0.000507
C -2.689422 1.688216 0.052089
C 0.383372 -0.689778 0.031577
C 1.508424 0.209155 -0.015894
C -0.207120 2.001968 -0.016899
C 1.162501 1.619469 -0.040654
C -2.964008 -1.306470 -1.304568
C -2.950061 -1.394823 1.312978
C -2.986948 2.536213 -1.214164
C -2.912051 2.520734 1.344338
C 2.903766 -0.139582 -0.032235
C 2.199119 2.608710 -0.081862
C 3.885668 0.852909 -0.073177
C 3.541854 2.239106 -0.098332
H -1.667248 -2.378194 -0.043001
H -3.421874 0.870010 0.070962
H -0.427808 3.076040 -0.023884
H -3.528112 -0.368555 -1.434062
H -3.693890 -2.137105 -1.299914
H -2.306924 -1.441140 -2.181708
H -2.291449 -1.630494 2.167185
H -3.711057 -2.194166 1.247249
H -3.473989 -0.449185 1.529389
H -2.318154 3.413705 -1.283657
H -4.027338 2.909848 -1.187238
H -2.856844 1.941019 -2.136058
H -2.734964 1.911463 2.249115
H -3.950435 2.899293 1.379607
H -2.235161 3.393695 1.389664
H 3.204234 -1.188650 -0.018748
H 1.908971 3.665717 -0.098677
H 4.940399 0.557708 -0.087150
H 4.329694 2.998809 -0.129755
H 0.375555 -4.006403 -1.669012


