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	hartrees
Energy at 0K	-112.781261
Energy at 298.15K	-112.780009
HF Energy	-112.781261
Nuclear repulsion energy	23.037873

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.630
O2	0.000	0.000	0.473

	C1	O2
C1		1.1026
O2	1.1026

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	0.357
2	O	-0.357

	x	y	z	Total
	0.000	0.000	-0.146	0.146
CHELPG
AIM
ESP

All results from a given calculation for CO (Carbon monoxide)

using model chemistry: HF/6-311+G(3df,2pd)

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>	10.963
(<r²>)^1/2	3.311