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	hartrees
Energy at 0K	-490.733401
Energy at 298.15K
HF Energy	-490.301953
Nuclear repulsion energy	61.254573

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.321
O2	0.000	0.000	-1.406

	Br1	O2
Br1		1.7278
O2	1.7278

All results from a given calculation for BrO (Bromine monoxide)

using model chemistry: CCD/cc-pVTZ-PP

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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