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	hartrees
Energy at 0K	-2610.524732
Energy at 298.15K	-2610.526381
HF Energy	-2610.196391
Nuclear repulsion energy	61.523376

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.542
Br2	0.000	0.000	0.264

	C1	Br2
C1		1.8063
Br2	1.8063

All results from a given calculation for CBr (Carbon monobromide)

using model chemistry: MP2/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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