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	hartrees
Energy at 0K	-853.031063
Energy at 298.15K	-853.030744
HF Energy	-853.031063
Nuclear repulsion energy	72.073192

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-1.029
Cl2	0.000	0.000	0.968

	S1	Cl2
S1		1.9971
Cl2	1.9971

Number	Element	Mulliken	CHELPG	AIM	ESP
1	S	0.158
2	Cl	-0.158

	x	y	z	Total
	0.000	0.000	-0.753	0.753
CHELPG
AIM
ESP

All results from a given calculation for SCl (sulfur monochloride)

using model chemistry: ROHF/3-21G*

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>	48.794
(<r²>)^1/2	6.985