%chk=000093995.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093995

0 1
 S   0.1366000       1.775600      -2.198600    
 S  -0.7330000       3.277800      0.8395000    
 P  -2.4499999E-02   1.699100     -8.0100000E-02
 O    1.453100       1.335100      0.5108000    
 O  -0.8264000      0.3328000      0.3194000    
 C    4.380000      -1.059600      0.3159000    
 C   -4.153900      -1.459700      0.1682000    
 C    3.501300      0.1198000      0.7626000    
 C   -2.676900      -1.172700      0.4827000    
 C    2.166500      0.2019000      3.1700000E-02
 C   -2.198400      0.1887000     -7.1999999E-03
 C    3.632500      -2.377100      0.5350000    
 C    4.807900     -0.9458000      -1.147800    
 C   -5.038900     -0.3842000      0.8028000    
 C   -4.426000      -1.531700      -1.334900    
 H    5.282200      -1.061700      0.9401000    
 H   -4.409700      -2.429700      0.6122000    
 H    3.312900      5.2800000E-02   1.842000    
 H    4.048000       1.061500      0.6231000    
 H   -2.509200      -1.241200       1.565600    
 H   -2.046500      -1.956600      4.3200001E-02
 H    2.326400      0.3115000      -1.042600    
 H    1.556700     -0.6865000      0.2135000    
 H   -2.310900      0.2769000      -1.090400    
 H   -2.756400      0.9951000      0.4735000    
 H    3.243900      -2.445600       1.556600    
 H    2.799900      -2.507500     -0.1634000    
 H    4.312500      -3.223200      0.3847000    
 H    5.294200      1.7000001E-02  -1.336300    
 H    5.525500      -1.735400      -1.396400    
 H    3.962800      -1.043400      -1.836200    
 H   -4.803100     -0.2543000       1.864200    
 H   -4.943500      0.5852000      0.3037000    
 H   -6.092500     -0.6776000      0.7338000    
 H   -3.761800      -2.257600      -1.815100    
 H   -5.457500      -1.851200      -1.519600    
 H   -4.289800     -0.5642000      -1.828100    
 H   -1.158400       1.990700      -2.471400    


%chk=000093995-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093995

0 1
S 0.135315 1.628471 -2.540464
S -0.903119 3.496525 0.537731
P -0.075838 1.778856 -0.220267
O 1.478156 1.415528 0.421015
O -0.864873 0.253232 0.045704
C 4.458393 -1.008839 0.387970
C -4.262871 -1.542038 0.057833
C 3.547843 0.220698 0.679861
C -2.731920 -1.267009 0.138510
C 2.178000 0.159003 -0.000113
C -2.345303 0.188369 -0.134943
C 3.854422 -2.332461 0.919161
C 4.831482 -1.127583 -1.110358
C -5.058354 -0.789075 1.153007
C -4.842550 -1.254182 -1.349389
H 5.397851 -0.823848 0.949807
H -4.381564 -2.628773 0.250807
H 3.388052 0.307520 1.771507
H 4.059566 1.145075 0.350595
H -2.363885 -1.539123 1.146402
H -2.203794 -1.912243 -0.589584
H 2.254679 0.155141 -1.104175
H 1.574246 -0.701683 0.334565
H -2.589316 0.495606 -1.169592
H -2.816376 0.888791 0.578822
H 3.569912 -2.245304 1.984478
H 2.952676 -2.625903 0.349309
H 4.584193 -3.158141 0.828896
H 5.255130 -0.181132 -1.495286
H 5.583710 -1.923391 -1.263126
H 3.951728 -1.382833 -1.730665
H -4.633572 -0.974140 2.157354
H -5.057614 0.303525 0.979995
H -6.113493 -1.119070 1.164402
H -4.271072 -1.780753 -2.136676
H -5.894770 -1.587403 -1.413265
H -4.825058 -0.172696 -1.582308
H 0.305587 2.996284 -2.690818


