%chk=000111420.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111420

0 1
 S   -2.645800      -1.122200       2.440400    
 S   -2.465800      -2.779700     -0.6359000    
 P   -2.435700      -1.072200      0.3255000    
 O   -1.050500     -0.2749000     -1.0300000E-02
 O   -3.520000     -3.7000000E-03 -0.2678000    
 C    1.345500      0.1119000     -8.8900000E-02
 C    2.681000     -0.4025000      0.4888000    
 C    1.369400      0.3570000      -1.614400    
 C    3.858800      0.5482000      0.2510000    
 C   0.2097000     -0.8341000      0.3340000    
 C    5.181700      2.0700000E-02  0.8131000    
 C    1.648600     -0.8754000      -2.463600    
 C    6.360100      0.9478000      0.5577000    
 C   -3.582700       1.313400      0.2528000    
 C   -2.240000       1.997800      4.6000000E-02
 C   -4.714300       2.067900     -0.4284000    
 H    1.137300       1.088800      0.3699000    
 H    2.569600     -0.5453000       1.571600    
 H    2.915300      -1.389700      7.2800003E-02
 H    2.106500       1.130500      -1.856500    
 H   0.4023000      0.7724000      -1.924000    
 H    3.635400       1.523200      0.7006000    
 H    3.994600      0.7141000     -0.8230000    
 H   0.2344000     -0.9739000       1.419700    
 H   0.3298000      -1.817000     -0.1290000    
 H    5.080500     -0.1349000       1.893700    
 H    5.400400     -0.9582000      0.3699000    
 H    2.626500      -1.308600      -2.235600    
 H    1.649400     -0.6014000      -3.523900    
 H   0.8842000      -1.644800      -2.325600    
 H    7.276100      0.5242000      0.9808000    
 H    6.516000       1.094400     -0.5157000    
 H    6.192500       1.926900       1.017400    
 H   -3.814200       1.272400       1.321500    
 H   -1.814900       1.794200     -0.9418000    
 H   -1.525600       1.738300      0.8320000    
 H   -2.357700       3.085300      0.1282000    
 H   -4.547400       2.127700      -1.509500    
 H   -5.663900       1.540800     -0.2857000    
 H   -4.815700       3.082700     -3.1900000E-02
 H   -3.873200      -1.660100       2.485400    


%chk=000111420-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111420

0 1
S -2.912986 -1.139059 2.332482
S -2.300953 -2.744908 -1.001390
P -2.376612 -0.990690 0.063820
O -0.935638 -0.032817 0.214972
O -3.456293 0.168119 -0.592542
C 1.500086 0.183420 0.103842
C 2.832451 -0.452066 0.594789
C 1.454103 0.466437 -1.423895
C 4.088121 0.396381 0.291861
C 0.343071 -0.718959 0.562085
C 5.372182 -0.193244 0.919517
C 1.633778 -0.769197 -2.334724
C 6.633229 0.637369 0.597851
C -3.626033 1.533426 0.044810
C -2.757240 2.533706 -0.725869
C -5.128412 1.816169 -0.028886
H 1.381721 1.157538 0.624796
H 2.769642 -0.608546 1.692520
H 2.957527 -1.459348 0.146612
H 2.233450 1.214938 -1.664855
H 0.482870 0.944461 -1.653329
H 3.936978 1.429329 0.669815
H 4.231972 0.481772 -0.803793
H 0.363048 -0.868612 1.658288
H 0.374360 -1.705313 0.058867
H 5.242967 -0.262385 2.019046
H 5.509957 -1.232642 0.557244
H 2.604309 -1.271571 -2.165751
H 1.598061 -0.468302 -3.397632
H 0.831297 -1.513986 -2.181684
H 7.536752 0.196776 1.057834
H 6.803143 0.693380 -0.494045
H 6.532979 1.672958 0.974386
H -3.297297 1.459877 1.101033
H -3.054354 2.560194 -1.788792
H -1.692755 2.255830 -0.657835
H -2.888572 3.546626 -0.301157
H -5.469728 1.797565 -1.078413
H -5.697737 1.062236 0.539906
H -5.343864 2.815389 0.392622
H -3.771379 -2.210249 2.136896


