%chk=000091914.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091914

0 1
 S   -4.039800       1.090200       1.068000    
 S    4.041100       1.094300      -1.063800    
 O   -1.468200       1.083900       2.231700    
 O    1.469500       1.099700      -2.227800    
 C   -1.443100       1.091600     -0.1518000    
 C    1.444500       1.092200      0.1558000    
 C  -0.6457000       1.094900      -1.298300    
 C   0.6469000       1.089400       1.302100    
 C  -0.8259000       1.088800       1.190200    
 C   0.8273000       1.095300      -1.186300    
 C   -2.838100       1.091600     -0.2717000    
 C    2.839400       1.092300      0.2756000    
 C   -1.243100       1.097900      -2.564400    
 C    1.244400       1.087200       2.568400    
 C   -3.429300       1.094500      -1.535500    
 C    3.430500       1.089800       1.539300    
 C   -2.633600       1.097600      -2.679200    
 C    2.634800       1.087300       2.683100    
 C   -4.846200     -0.4407000      0.6376000    
 C    4.845700     -0.4392000     -0.6391000    
 C   -4.114800      -1.627600      0.6022000    
 C    4.112900      -1.625300     -0.6082000    
 C   -6.208000     -0.4505000      0.3369000    
 C    6.207400     -0.4516000     -0.3383000    
 C   -4.745500      -2.825300      0.2656000    
 C    4.742200      -2.824900     -0.2760000    
 C   -6.838700      -1.648200      3.0000001E-04
 C    6.836700      -1.651500     -6.3000000E-03
 C   -6.107400      -2.835600     -3.5200000E-02
 C    6.104000      -2.838100      2.4800001E-02
 H  -0.6489000       1.101500      -3.474200    
 H   0.6502000       1.086400       3.478100    
 H   -4.507500       1.117500      -1.676400    
 H    4.508800       1.112300       1.680300    
 H   -3.095900       1.104900      -3.662200    
 H    3.097200       1.090400       3.666100    
 H   -3.054500      -1.647800      0.8424000    
 H    3.052600      -1.643300     -0.8484000    
 H   -6.794000      0.4650000      0.3587000    
 H    6.794500      0.4632000     -0.3568000    
 H   -4.176800      -3.750200      0.2400000    
 H    4.172400      -3.749300     -0.2538000    
 H   -7.899100      -1.656500     -0.2341000    
 H    7.897100      -1.661900      0.2283000    
 H   -6.598700      -3.768300     -0.2969000    
 H    6.594100      -3.772300      0.2830000    


%chk=000091914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091914

0 1
S -3.959485 -0.308014 1.338195
S 3.958523 -0.305109 -1.338599
O -1.473076 -0.309888 2.321424
O 1.472620 -0.300804 -2.321396
C -1.483128 -0.304878 -0.079368
C 1.482622 -0.306276 0.079362
C -0.695628 -0.302507 -1.275997
C 0.695121 -0.308329 1.275990
C -0.802286 -0.307442 1.232931
C 0.801785 -0.303298 -1.232933
C -2.913902 -0.304586 -0.181437
C 2.913391 -0.307378 0.181386
C -1.313259 -0.299532 -2.544349
C 1.312740 -0.311245 2.544341
C -3.510962 -0.301678 -1.468043
C 3.510445 -0.310250 1.468010
C -2.719590 -0.299093 -2.633735
C 2.719074 -0.312134 2.633699
C -5.664885 -0.307035 0.588619
C 5.664400 -0.306977 -0.590102
C -6.331079 -1.534373 0.364287
C 6.330076 -1.535313 -0.369590
C -6.331979 0.920594 0.368889
C 6.332314 0.919657 -0.367361
C -7.668404 -1.531700 -0.097306
C 7.667615 -1.534705 0.091371
C -7.669317 0.918592 -0.092730
C 7.669881 0.915586 0.093526
C -8.337433 -0.306351 -0.327420
C 8.337428 -0.310370 0.324554
H -0.675616 -0.297889 -3.432747
H 0.675111 -0.312807 3.432748
H -4.600306 -0.301365 -1.558936
H 4.599772 -0.311038 1.558986
H -3.209724 -0.296876 -3.613049
H 3.209219 -0.314443 3.613008
H -5.808199 -2.478007 0.552144
H 5.806614 -2.478133 -0.559908
H -5.809895 1.863966 0.560189
H 5.810682 1.863860 -0.555748
H -8.184777 -2.482185 -0.270862
H 8.183549 -2.485968 0.261936
H -8.186564 1.869282 -0.262585
H 8.187749 1.865507 0.265767
H -9.374666 -0.305965 -0.680557
H 9.374830 -0.311503 0.677196


