%chk=000101177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101177

0 1
 S   0.8716000      -2.237800      0.1587000    
 O    2.922400       1.685900     -0.4071000    
 N    1.351000      0.4546000      0.7925000    
 C   0.3455000     -0.6262000      0.8396000    
 C    2.273200     -0.4111000      -1.319200    
 C    2.406100      -1.772700     -0.6756000    
 C   -1.026500     -0.2300000      0.3152000    
 C    2.222400      0.6798000     -0.2745000    
 C    1.292900       1.436100       1.872600    
 C   -2.167700     -0.8389000      0.8312000    
 C   -1.134700      0.7393000     -0.6785000    
 C   -3.425600     -0.4759000      0.3500000    
 C   -2.392700       1.102400      -1.159700    
 C   -3.538100      0.4946000     -0.6454000    
 H   0.2197000     -0.8357000       1.910000    
 H    1.400500     -0.3394000      -1.976500    
 H    3.157800     -0.2299000      -1.942000    
 H    2.624600      -2.530800      -1.434000    
 H    3.221400      -1.789000      5.5700000E-02
 H   0.3286000       1.950700       1.837700    
 H    2.091200       2.177900       1.787400    
 H    1.398900      0.9174000       2.829900    
 H   -2.095000      -1.595000       1.608200    
 H  -0.2706000       1.234600      -1.106500    
 H   -4.317500     -0.9487000      0.7507000    
 H   -2.480800       1.857800      -1.935000    
 H   -4.517500      0.7773000      -1.020100    


%chk=000101177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101177

0 1
S 1.046915 -2.100426 1.095609
O 3.000333 1.485148 -0.612572
N 1.381506 0.677991 0.865304
C 0.336846 -0.300637 1.163606
C 1.797483 -0.572008 -1.224691
C 2.044881 -1.924507 -0.518679
C -0.958125 -0.119050 0.356821
C 2.111803 0.625988 -0.325990
C 1.740908 1.658869 1.906933
C -1.935687 -1.144662 0.311986
C -1.239201 1.123102 -0.268863
C -3.166730 -0.935085 -0.347425
C -2.468833 1.329989 -0.934251
C -3.438692 0.302915 -0.975111
H 0.096851 -0.208036 2.238062
H 0.753311 -0.526028 -1.582682
H 2.462455 -0.490551 -2.101306
H 1.744763 -2.758677 -1.172759
H 3.106967 -2.034055 -0.246449
H 0.872792 2.289798 2.172050
H 2.543922 2.295808 1.504470
H 2.104819 1.142856 2.815460
H -1.715381 -2.112982 0.774476
H -0.493830 1.925386 -0.241720
H -3.910034 -1.739738 -0.376822
H -2.667257 2.292603 -1.418813
H -4.391684 0.463291 -1.491343


