%chk=000120946.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120946

0 1
 S   -2.464300      -1.678800       1.137200    
 P   -3.127300     -0.2836000     -0.2828000    
 O   -1.937500      0.7899000     -0.5588000    
 O   -4.315000      0.6437000      0.3274000    
 O   -3.563400     -0.9858000      -1.542800    
 C    2.997900     -0.6016000      0.5053000    
 C    1.928900      -1.184300     -0.4221000    
 C    4.223200     -0.1381000     -0.2849000    
 C   0.7151000      -1.678500      0.3688000    
 C    5.340300      0.4260000      0.5986000    
 C  -0.3327000      -2.303200     -0.5584000    
 C    6.601300      0.8860000     -0.1367000    
 C   -1.525400      -2.907000      0.1826000    
 C    7.697400       1.387000      0.7904000    
 C   -1.995900       1.587700      -1.728900    
 C   -4.097000       1.386100       1.514600    
 C  -0.7890000       2.500800      -1.763900    
 C   -5.356700       2.153700       1.854400    
 H    2.581000      0.2438000       1.065800    
 H    3.301600      -1.358400       1.238500    
 H    1.611600     -0.4223000      -1.144500    
 H    2.356300      -2.016000     -0.9952000    
 H    4.621600     -0.9806000     -0.8636000    
 H    3.920500      0.6282000      -1.009200    
 H   0.2890000     -0.8338000      0.9208000    
 H    1.037200      -2.421900       1.108100    
 H    4.941100       1.271000       1.174000    
 H    5.623800     -0.3397000       1.332300    
 H  -0.6711000      -1.563500      -1.293000    
 H   0.1426000      -3.106500      -1.135900    
 H    6.995300      5.3800002E-02 -0.7320000    
 H    6.337200       1.683200     -0.8414000    
 H   -2.205400      -3.377700     -0.5346000    
 H   -1.185100      -3.686600      0.8720000    
 H    8.013100      0.6002000       1.482700    
 H    8.570800       1.702500      0.2113000    
 H    7.350100       2.242600       1.378100    
 H   -1.998200      0.9387000      -2.610000    
 H   -2.918900       2.175700      -1.718600    
 H   -3.847200      0.7070000       2.334300    
 H   -3.264000       2.079400       1.363300    
 H  -0.7668000       3.143700     -0.8778000    
 H   0.1369000       1.916000      -1.755400    
 H  -0.8011000       3.130900      -2.657500    
 H   -5.628200       2.829900       1.037000    
 H   -6.199700       1.469000       1.994300    
 H   -5.222800       2.740100       2.767800    


%chk=000120946-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120946

0 1
S -1.954422 -0.520397 1.359651
P -3.258291 0.019262 -0.441335
O -2.598428 1.582126 -0.829634
O -4.852386 0.373821 0.155418
O -3.316738 -1.044859 -1.621600
C 3.696176 -0.789375 0.664699
C 2.483338 -1.235242 -0.183003
C 4.954699 -0.487477 -0.179961
C 1.209548 -1.475305 0.657715
C 6.173902 -0.060799 0.668625
C 0.011584 -1.950853 -0.190854
C 7.423877 0.270163 -0.178896
C -1.285094 -2.152491 0.603380
C 8.639393 0.687571 0.677143
C -3.035822 2.220396 -2.114575
C -5.002098 1.223887 1.372818
C -2.306930 3.558311 -2.183295
C -6.501266 1.312200 1.643473
H 3.421906 0.114570 1.247887
H 3.933522 -1.578361 1.408866
H 2.270886 -0.463708 -0.952256
H 2.743956 -2.162198 -0.736151
H 5.220620 -1.384635 -0.777739
H 4.719625 0.313867 -0.911646
H 0.933570 -0.537025 1.180710
H 1.423362 -2.227503 1.446401
H 5.903272 0.824860 1.281198
H 6.423213 -0.869860 1.386920
H -0.173976 -1.243674 -1.022093
H 0.260796 -2.925999 -0.661867
H 7.689698 -0.612845 -0.795553
H 7.174560 1.082583 -0.891893
H -2.092550 -2.558734 -0.029210
H -1.142283 -2.803576 1.483810
H 8.925615 -0.119953 1.377333
H 9.519557 0.918131 0.048872
H 8.409204 1.586527 1.279919
H -2.761114 1.554497 -2.953325
H -4.135613 2.349023 -2.101892
H -4.463603 0.743996 2.213721
H -4.557934 2.218998 1.178407
H -2.581109 4.199261 -1.328217
H -1.214722 3.405202 -2.168652
H -2.575447 4.084943 -3.118033
H -7.026683 1.773206 0.790106
H -6.924404 0.307934 1.812653
H -6.683867 1.928235 2.543557


