%chk=000080038.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080038

0 1
 S  -0.7906000       1.810900     -0.4382000    
 S   0.8202000       1.632800      0.8188000    
 S   -2.874700      0.4384000       2.067900    
 S    2.468100      0.6156000      -2.129300    
 P   -2.067100      0.2656000      0.2874000    
 P    2.030400      0.2453000     -0.2503000    
 O   -1.250900      -1.144100      0.1356000    
 O   -3.233700      2.1900000E-02 -0.8315000    
 O    3.356200      3.4699999E-02  0.6814000    
 O    1.335500      -1.221300     -4.5000002E-02
 C   -1.906300      -2.378100      0.3763000    
 C   -4.223000       1.007700      -1.075100    
 C    4.312600       1.070500      0.8309000    
 C    2.023200      -2.400100     -0.4289000    
 H   -2.920600      -2.375400     -2.9999999E-02
 H   -1.933400      -2.579100       1.450000    
 H   -1.336400      -3.172400     -0.1127000    
 H   -4.608500      0.8703000      -2.088400    
 H   -3.806800       2.014300     -0.9892000    
 H   -5.045300      0.8849000     -0.3658000    
 H    4.884800      0.8866000       1.743700    
 H    3.828400       2.046800      0.9077000    
 H    4.996400       1.063000     -2.1500001E-02
 H    3.063100      -2.375200     -9.4599999E-02
 H    1.982000      -2.517200      -1.514500    
 H    1.526400      -3.256300      3.4299999E-02


%chk=000080038-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080038

0 1
S -0.852820 1.374088 -1.021453
S 0.432716 1.400290 0.777795
S -2.191522 -1.293114 1.319034
S 1.797403 -1.397764 -1.462060
P -2.560521 -0.216893 -0.395433
P 1.976465 -0.331054 0.300263
O -2.823387 -1.018555 -1.898728
O -3.997757 0.740457 -0.514528
O 3.516742 0.449034 0.553471
O 1.871007 -1.131736 1.821975
C -2.008506 -2.225293 -2.190259
C -4.270965 1.689512 0.588544
C 4.105744 1.213662 -0.567436
C 2.712669 -2.336524 2.043745
H -2.238965 -3.028023 -1.467732
H -0.929043 -1.989885 -2.168109
H -2.321807 -2.513741 -3.203953
H -5.253040 2.116371 0.339316
H -3.504810 2.485884 0.617050
H -4.314435 1.163887 1.559657
H 5.109672 1.493230 -0.215497
H 3.508921 2.121206 -0.771783
H 4.174910 0.589648 -1.477224
H 3.782151 -2.064610 2.042115
H 2.503058 -3.101585 1.274556
H 2.406119 -2.698393 3.035674


