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	hartrees
Energy at 0K	-2634.565110
Energy at 298.15K	-2634.567890
HF Energy	-2634.421525
Nuclear repulsion energy	78.563468

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.351
O2	0.000	0.000	-1.535

	Br1	O2
Br1		1.8860
O2	1.8860

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

using model chemistry: QCISD/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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