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	hartrees
Energy at 0K	-2969.983968
Energy at 298.15K
HF Energy	-2969.983968
Nuclear repulsion energy	138.211523

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-1.471
Br2	0.000	0.000	0.673

	S1	Br2
S1		2.1441
Br2	2.1441

Number	Element	Mulliken	CHELPG	AIM	ESP
1	S	0.025
2	Br	-0.025

	x	y	z	Total
	0.000	0.000	-0.203	0.203
CHELPG
AIM
ESP

All results from a given calculation for SBr (Sulfur monobromide radical)

using model chemistry: ROHF/cc-pV(T+d)Z

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>	69.655
(<r²>)^1/2	8.346