# b3pw91/6-311+g(df,pd) prop scf=tight
c-NH2SH ro Lovas et al 1983
0 1
N
S 1 B1
H
2 B2 1 A1
H
1 B3 2 A2 3 D
H
1 B3 2 A2 3
-D
B1 1.705
B2 1.351
B3 1.008
A1 101.9
A2
-112.7
D 116.3