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	hartrees
Energy at 0K	-2971.874360
Energy at 298.15K
HF Energy	-2971.727829
Nuclear repulsion energy	138.362750

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-1.470
Br2	0.000	0.000	0.672

	S1	Br2
S1		2.1418
Br2	2.1418

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

using model chemistry: B2PLYP=FULL/cc-pVTZ

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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