%chk=000089980.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089980

0 1
 S    2.512200     -9.7999997E-02 -2.5300000E-02
 P   -1.992500      0.1765000     -0.7294000    
 O  -0.4444000     -0.2915000     -0.8347000    
 O    2.734800       1.311200      0.2483000    
 O    1.717400     -0.9112000      0.8788000    
 O   -2.597900     -0.7007000      0.4910000    
 O   -1.921900       1.669300     -0.1035000    
 O   -2.761300      7.2999999E-02  -2.016100    
 C    1.824900     -0.2431000      -1.646100    
 C    4.104700     -0.8724000     -0.1850000    
 C   0.4397000      0.3688000      -1.724400    
 C    4.865700     -0.8501000       1.121700    
 C   -2.695600      -2.105400      0.3291000    
 C   -1.215900       1.859500       1.110700    
 C   -3.284400      -2.707000       1.587300    
 C   -1.285500       3.321300       1.497700    
 H    2.504300      0.2515000      -2.345800    
 H    1.781600      -1.313200      -1.873200    
 H    3.939700      -1.902600     -0.5141000    
 H    4.658100     -0.3331000     -0.9594000    
 H   0.4719000       1.433400      -1.472000    
 H   4.9500000E-02  0.2705000      -2.742500    
 H    5.841500      -1.330800       1.002000    
 H    5.031800      0.1758000       1.465900    
 H    4.319100      -1.381100       1.907700    
 H   -1.699400      -2.519100      0.1438000    
 H   -3.335200      -2.325400     -0.5312000    
 H  -0.1723000       1.559400      0.9869000    
 H   -1.666900       1.247500       1.897700    
 H   -3.374200      -3.793000       1.496100    
 H   -2.657500      -2.475500       2.454800    
 H   -4.274800      -2.285800       1.789000    
 H  -0.7515000       3.503400       2.434500    
 H  -0.8477000       3.948300      0.7139000    
 H   -2.326400       3.640000       1.616300    


%chk=000089980-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089980

0 1
S 2.488121 0.065247 -0.019679
P -2.039377 0.265225 -0.681352
O -0.561498 -0.673717 -0.815404
O 2.201752 1.644940 -0.368554
O 2.031909 -0.552567 1.426415
O -2.875873 -0.740290 0.432843
O -1.655151 1.615158 0.272862
O -2.706586 0.606663 -2.076941
C 1.704635 -0.973238 -1.495699
C 4.409779 -0.227180 -0.191366
C 0.391442 -0.326263 -1.886484
C 5.095433 0.405922 1.015082
C -3.379849 -2.069650 -0.029905
C -0.982682 1.450174 1.618066
C -4.142845 -2.663137 1.149398
C -0.258342 2.764407 1.879612
H 2.456295 -0.923480 -2.301426
H 1.589616 -1.987521 -1.084965
H 4.515699 -1.323956 -0.236384
H 4.659250 0.245815 -1.154894
H 0.511258 0.772472 -1.977554
H 0.037626 -0.732139 -2.854009
H 6.183976 0.222715 0.955508
H 4.929424 1.496329 1.041846
H 4.721137 -0.033025 1.955874
H -2.512491 -2.693698 -0.316275
H -4.032109 -1.917709 -0.910649
H -0.278504 0.598195 1.581652
H -1.784410 1.245547 2.348845
H -4.543485 -3.656932 0.875633
H -3.478093 -2.780965 2.021746
H -4.985366 -2.011279 1.435227
H 0.193278 2.736589 2.889414
H 0.546762 2.906200 1.139865
H -0.959131 3.615548 1.832152


