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	hartrees
Energy at 0K	-92.612451
Energy at 298.15K	-92.611197
HF Energy	-92.612451
Nuclear repulsion energy	18.985096

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.630
N2	0.000	0.000	0.540

	C1	N2
C1		1.1707
N2	1.1707

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	-0.371
2	N	0.371

	x	y	z	Total
	0.000	0.000	-1.486	1.486
CHELPG
AIM
ESP

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

using model chemistry: PBE1PBE/daug-cc-pVDZ

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>	11.190
(<r²>)^1/2	3.345