Calculated impact sensitivity (h₅₀) of the predicted BN-cage compounds and CL-20. Experimental parameters of CL-20 are labeled in parentheses.

Compounds	Methods	NO2-1-1	NO2-2-1	CL-20
σ + 2	M06-2X	292.859	417.062	231.351
	ωB97XD	302.761	437.273	233.923
	B3LYP	278.559	422.418	306.392
ν	M06-2X	0.227	0.168	0.068
	ωB97XD	0.220	0.167	0.065
	B3LYP	0.231	0.175	0.058
h 50 (cm)	M06-2X	49.498	34.459	11.506
	ωB97XD	47.745	34.089	10.765
	B3LYP	50.555	36.115	8.611