Number of bonds in different types of bonds and the sum of BO for each type in RBD with BL cutoff of 2.5 Å.

Bond type	Sum of BO of type	No. of Bonds
C–H	0.4074	1
N–C	61.6410	140
N–H	0.3395	1
N⋯H	0.2297	4
O–H	0.2555	1
O⋯H	2.9788	89
S–S	0.3324	2
Total	66.1843	238