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	hartrees
Energy at 0K	-38.279342
Energy at 298.15K
HF Energy	-38.279342
Nuclear repulsion energy	2.875635

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.158
H2	0.000	0.000	-0.946

	C1	H2
C1		1.1041
H2	1.1041

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	-0.067
2	H	0.067

	x	y	z	Total
	0.000	0.000	-1.612	1.612
CHELPG
AIM
ESP

All results from a given calculation for CH (Methylidyne)

using model chemistry: ROHF/cc-pVQZ

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>	5.427
(<r²>)^1/2	2.330