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	hartrees
Energy at 0K	-15.291884
Energy at 298.15K	-15.290641
Nuclear repulsion energy	8.023766

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.950
S2	0.000	0.000	0.633

	C1	S2
C1		1.5828
S2	1.5828

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	-0.037
2	S	0.037

	x	y	z	Total
	0.000	0.000	0.785	0.785
CHELPG
AIM
ESP

All results from a given calculation for CS (carbon monosulfide)

using model chemistry: HF/CEP-121G

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>	17.828
(<r²>)^1/2	4.222