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	hartrees
Energy at 0K	-92.745792
Energy at 298.15K	-92.744538
HF Energy	-92.745792
Nuclear repulsion energy	19.113698

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.626
N2	0.000	0.000	0.537

	C1	N2
C1		1.1628
N2	1.1628

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	0.011
2	N	-0.011

	x	y	z	Total
	0.000	0.000	-1.322	1.322
CHELPG
AIM
ESP

All results from a given calculation for CN (Cyano radical)

using model chemistry: B3LYPultrafine/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	11.095
(<r²>)^1/2	3.331