%chk=000153523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153523

0 1
 S   -1.205700      -1.293800       1.481300    
 O    1.965800      -3.055300     -0.9563000    
 O   4.3400001E-02  -3.126900      0.1012000    
 O    3.960900       2.701900      4.7600001E-02
 O    4.634600      0.8929000     -0.9978000    
 O   -3.212800      0.6919000      -2.563000    
 N   -2.379200     -0.1555000     -0.6194000    
 N    1.077400      -2.516700     -0.2561000    
 N    3.793200       1.507400     -0.2983000    
 N   -4.225900       1.343700     -0.6170000    
 C   0.3011000     -0.4987000      0.9271000    
 C    1.249600      -1.162200      0.1486000    
 C    2.615700      0.8302000      0.1146000    
 C    2.406800     -0.4978000     -0.2576000    
 C   0.5099000      0.8292000       1.299300    
 C    1.667000       1.493800      0.8929000    
 C   -2.397000     -0.2611000      0.7472000    
 C   -3.300400      0.4090000       1.468100    
 C   -3.276200      0.6358000      -1.334100    
 C   -4.228200       1.232200      0.6718000    
 H    3.150900      -1.008100     -0.8648000    
 H  -0.2073000       1.368700       1.913300    
 H    1.797100       2.527500       1.203200    
 H   -1.677900     -0.6864000      -1.126800    
 H   -3.387400      0.3857000       2.545600    
 H   -4.978600       1.790400       1.254400    


%chk=000153523-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153523

0 1
S -1.316995 -1.622635 0.485525
O 2.747053 -3.398552 0.028102
O 0.503503 -3.503189 0.427235
O 3.917012 2.769192 0.009050
O 5.070782 0.800192 -0.108530
O -4.115370 1.642318 -2.282264
N -2.873413 0.252661 -0.871366
N 1.602902 -2.845370 0.222196
N 3.981565 1.480740 -0.003342
N -4.528978 1.777661 0.050943
C 0.263175 -0.691135 0.335212
C 1.515371 -1.368381 0.219610
C 2.704738 0.731593 0.112697
C 2.734141 -0.668649 0.103963
C 0.288751 0.729626 0.346190
C 1.490459 1.443599 0.236403
C -2.520921 -0.208807 0.376835
C -3.162434 0.307141 1.491454
C -3.885200 1.279474 -1.106608
C -4.175533 1.307219 1.250731
H 3.674662 -1.218582 0.012092
H -0.644381 1.287960 0.453994
H 1.505397 2.536614 0.247215
H -2.443717 -0.139161 -1.717088
H -2.920294 -0.035044 2.497711
H -4.715475 1.731316 2.107039


