%chk=000071003.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071003

0 1
 S    4.863500     -0.8170000      -1.491100    
 O   -2.797600     -0.4615000     -4.7600001E-02
 O   -2.573200       1.795900     -0.4385000    
 N    3.416000     -0.1789000      0.7881000    
 C  -0.6611000      0.4705000      8.3200000E-02
 C   0.2374000       1.535100      1.1200000E-02
 C  -0.2015000     -0.8104000      0.3896000    
 C   -2.076800      0.6959000     -0.1611000    
 C    2.054800      3.7900001E-02  0.5518000    
 C    1.595300       1.318800      0.2455000    
 C    1.156400      -1.026700      0.6239000    
 C   -4.209200     -0.3689000     -0.2677000    
 C   -4.825700      -1.741300     -9.8999999E-02
 C    4.021700     -0.4493000     -0.1882000    
 H  -9.9699996E-02   2.540800     -0.2254000    
 H  -0.8640000      -1.668700      0.4571000    
 H   -4.645400      0.3262000      0.4579000    
 H   -4.395400       0.000000      -1.282300    
 H    2.285900       2.156400      0.1890000    
 H    1.503200      -2.028500      0.8643000    
 H   -5.906600      -1.707100     -0.2606000    
 H   -4.384300      -2.451400     -0.8061000    
 H   -4.630200      -2.130400      0.9057000    


%chk=000071003-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071003

0 1
S 6.244398 -0.621073 0.253529
O -2.937868 -0.500072 -0.022554
O -2.698968 1.810278 -0.238166
N 3.441892 -0.206877 0.134578
C -0.717835 0.400441 -0.046511
C 0.169978 1.505464 -0.124575
C -0.193917 -0.911575 0.092914
C -2.182092 0.670767 -0.113970
C 2.080447 -0.007124 0.074995
C 1.559209 1.311405 -0.064809
C 1.194406 -1.119703 0.153683
C -4.421102 -0.322782 -0.078828
C -5.036944 -1.710909 0.059118
C 4.635373 -0.382541 0.181490
H -0.252475 2.509591 -0.231656
H -0.883515 -1.757555 0.152524
H -4.719012 0.358577 0.738544
H -4.674837 0.162158 -1.038836
H 2.249425 2.158061 -0.124050
H 1.607687 -2.126987 0.260899
H -6.138908 -1.634257 0.023225
H -4.708849 -2.372548 -0.760724
H -4.752994 -2.175337 1.018882


